USER MOD reduce.3.24.130724 H: found=0, std=0, add=1658, rem=0, adj=52 USER MOD reduce.3.24.130724 removed 1653 hydrogens (32 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD NoAdj-H: A 18 HIS HE2 : A 18 HIS NE2 : A 104 HECFE :(H bumps) USER MOD NoAdj-H: A 104 HEC HAC : A 104 HEC CAC : A 17 CYS SG :(H bumps) USER MOD NoAdj-H: A 104 HEC HAB : A 104 HEC CAB : A 14 CYS SG :(H bumps) USER MOD Set 1.1: B 97 THR OG1 : rot 180:sc= -0.341 USER MOD Set 1.2: B 100 MET CE :methyl -145:sc=-0.00471 (180deg=-0.209) USER MOD Set 2.1: B 56 HIS : no HE2:sc= -1.93! C(o=3!,f=-7.3!) USER MOD Set 2.2: B 85 THR OG1 : rot -49:sc= 1.61 USER MOD Set 2.3: B 88 SER OG : rot -101:sc= 3.3 USER MOD Set 3.1: B 21 THR OG1 : rot 120:sc= -0.0815 USER MOD Set 3.2: B 36 ASN : amide:sc= -0.395! K(o=-0.48!,f=-1) USER MOD Set 4.1: B 10 HIS : no HD1:sc= 0.43 K(o=1.5,f=-4.3!) USER MOD Set 4.2: B 20 THR OG1 : rot -86:sc= 1.09 USER MOD Set 5.1: A 49 THR OG1 : rot -114:sc= 1.43 USER MOD Set 5.2: A 78 THR OG1 : rot 180:sc= 0.678 USER MOD Set 5.3: A 104 HEC O2D : rot 8:sc= 1.88 USER MOD Set 6.1: A 63 ASN : amide:sc= -0.978 K(o=-0.13,f=-8.7!) USER MOD Set 6.2: A 74 TYR OH : rot 118:sc= 0.847 USER MOD Set 7.1: A 52 ASN : amide:sc= -0.557 K(o=-1.6,f=-5.6!) USER MOD Set 7.2: A 104 HEC O2A : rot 27:sc= -1.06 USER MOD Set 8.1: A 46 TYR OH : rot 29:sc= 1.18 USER MOD Set 8.2: A 79 LYS NZ :NH3+ 131:sc= 1.15 (180deg=0.783) USER MOD Set 9.1: A 19 THR OG1 : rot -119:sc= 1.79 USER MOD Set 9.2: A 31 ASN : amide:sc= 1.65 K(o=3.4,f=-1.2!) USER MOD Set10.1: A -4 THR OG1 : rot -15:sc= -2.17 USER MOD Set10.2: A 62 ASN : amide:sc= -3.33! C(o=-5.5!,f=-10!) USER MOD Single : A 2 SER OG : rot 170:sc= 0.536 USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 LYS NZ :NH3+ 165:sc= -0.432 (180deg=-1.09) USER MOD Single : A 8 THR OG1 : rot -26:sc= 0.351 USER MOD Single : A -1 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A -4 THR N :NH3+ -153:sc= 0.0367 (180deg=-0.414) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 THR OG1 : rot -80:sc= 0.903 USER MOD Single : A 16 GLN :FLIP amide:sc= -4.02! C(o=-5.2!,f=-4!) USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 HIS : no HD1:sc= 1.96 K(o=2,f=-11!) USER MOD Single : A 27 LYS NZ :NH3+ -170:sc= 0.863 (180deg=0.802) USER MOD Single : A 33 HIS : no HE2:sc= 1.11 K(o=1.1,f=-6.3!) USER MOD Single : A 39 HIS : no HD1:sc= -1.21 X(o=-1.2,f=-0.74) USER MOD Single : A 40 SER OG : rot 116:sc= 0.738 USER MOD Single : A 42 GLN : amide:sc= -0.0564 X(o=-0.056,f=0) USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 48 TYR OH : rot -26:sc= 1.04 USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 LYS NZ :NH3+ -175:sc= 0.798 (180deg=0.782) USER MOD Single : A 56 ASN :FLIP amide:sc= -0.121 F(o=-0.73,f=-0.12) USER MOD Single : A 64 MET CE :methyl 152:sc= -0.25 (180deg=-1.11) USER MOD Single : A 65 SER OG : rot 180:sc= 0.69 USER MOD Single : A 67 TYR OH : rot -131:sc= 1.05 USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 70 ASN : amide:sc= -0.0696 K(o=-0.07,f=-2) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 MET CE :methyl 179:sc= -0.906 (180deg=-0.917) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0.553! (180deg=0.553!) USER MOD Single : A 87 LYS NZ :NH3+ 167:sc= -0.0624 (180deg=-0.21) USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 ASN : amide:sc= -0.857 K(o=-0.86,f=-1.9!) USER MOD Single : A 96 THR OG1 : rot 92:sc= 1.51 USER MOD Single : A 97 TYR OH : rot 165:sc= 0 USER MOD Single : A 99 LYS NZ :NH3+ -128:sc= -3.79! (180deg=-5.43!) USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 THR OG1 : rot 107:sc= 0.272 USER MOD Single : B 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 8 THR OG1 : rot 180:sc= 0 USER MOD Single : B 13 ASN : amide:sc= 0.449 K(o=0.45,f=-5.5!) USER MOD Single : B 18 THR OG1 : rot 180:sc= 0 USER MOD Single : B 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 28 SER OG : rot 180:sc= 0.47 USER MOD Single : B 35 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 37 ASN : amide:sc= 0 X(o=0,f=-0.12) USER MOD Single : B 49 THR OG1 : rot -16:sc= 0.47 USER MOD Single : B 53 SER OG : rot -134:sc= 0 USER MOD Single : B 54 THR OG1 : rot -69:sc= 1.77 USER MOD Single : B 61 GLN : amide:sc= 0.293 K(o=0.29,f=-0.75) USER MOD Single : B 62 HIS : no HD1:sc= 0.0585 K(o=0.059,f=-0.73) USER MOD Single : B 66 LYS NZ :NH3+ 143:sc= -0.183 (180deg=-1.27!) USER MOD Single : B 71 THR OG1 : rot 180:sc= 0.0647 USER MOD Single : B 75 ASN : amide:sc=-0.00173 X(o=-0.0017,f=-0.16) USER MOD Single : B 77 MET CE :methyl -123:sc= -0.867 (180deg=-2.91) USER MOD Single : B 82 TYR OH : rot 180:sc= 0 USER MOD Single : B 93 GLN : amide:sc= 0.599 K(o=0.6,f=-0.048) USER MOD Single : B 95 SER OG : rot 131:sc= -3.37! USER MOD Single : B 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 102 ASN : amide:sc= -0.0182 X(o=-0.018,f=-0.0083) USER MOD Single : B 103 MET CE :methyl -179:sc= 0 (180deg=-4.98e-05) USER MOD Single : B 104 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N THR A -4 -18.536 14.327 -5.257 1.00 0.00 N ATOM 2 CA THR A -4 -17.237 13.881 -5.918 1.00 0.00 C ATOM 3 C THR A -4 -17.708 12.888 -7.000 1.00 0.00 C ATOM 4 O THR A -4 -18.635 13.219 -7.774 1.00 0.00 O ATOM 5 CB THR A -4 -16.278 13.379 -4.842 1.00 0.00 C ATOM 6 OG1 THR A -4 -16.768 12.267 -4.098 1.00 0.00 O ATOM 7 CG2 THR A -4 -15.901 14.443 -3.814 1.00 0.00 C ATOM 0 H1 THR A -4 -18.414 15.280 -4.859 1.00 0.00 H new ATOM 0 H2 THR A -4 -19.298 14.343 -5.965 1.00 0.00 H new ATOM 0 H3 THR A -4 -18.784 13.663 -4.496 1.00 0.00 H new ATOM 0 HA THR A -4 -16.640 14.648 -6.411 1.00 0.00 H new ATOM 0 HB THR A -4 -15.409 13.085 -5.430 1.00 0.00 H new ATOM 0 HG1 THR A -4 -17.732 12.174 -4.246 1.00 0.00 H new ATOM 0 HG21 THR A -4 -15.217 14.015 -3.081 1.00 0.00 H new ATOM 0 HG22 THR A -4 -15.416 15.279 -4.317 1.00 0.00 H new ATOM 0 HG23 THR A -4 -16.800 14.796 -3.309 1.00 0.00 H new ATOM 17 N GLU A -3 -17.158 11.707 -6.917 1.00 0.00 N ATOM 18 CA GLU A -3 -17.509 10.522 -7.738 1.00 0.00 C ATOM 19 C GLU A -3 -17.182 9.338 -6.803 1.00 0.00 C ATOM 20 O GLU A -3 -16.812 8.219 -7.221 1.00 0.00 O ATOM 21 CB GLU A -3 -16.684 10.446 -8.992 1.00 0.00 C ATOM 22 CG GLU A -3 -16.765 11.672 -9.928 1.00 0.00 C ATOM 23 CD GLU A -3 -16.059 11.508 -11.243 1.00 0.00 C ATOM 24 OE1 GLU A -3 -16.109 10.263 -11.669 1.00 0.00 O ATOM 25 OE2 GLU A -3 -15.539 12.483 -11.744 1.00 0.00 O ATOM 0 H GLU A -3 -16.413 11.509 -6.249 1.00 0.00 H new ATOM 0 HA GLU A -3 -18.545 10.542 -8.075 1.00 0.00 H new ATOM 0 HB2 GLU A -3 -15.642 10.297 -8.710 1.00 0.00 H new ATOM 0 HB3 GLU A -3 -16.992 9.564 -9.553 1.00 0.00 H new ATOM 0 HG2 GLU A -3 -17.814 11.896 -10.120 1.00 0.00 H new ATOM 0 HG3 GLU A -3 -16.345 12.535 -9.411 1.00 0.00 H new ATOM 32 N PHE A -2 -17.282 9.670 -5.529 1.00 0.00 N ATOM 33 CA PHE A -2 -16.978 8.925 -4.325 1.00 0.00 C ATOM 34 C PHE A -2 -18.054 9.279 -3.283 1.00 0.00 C ATOM 35 O PHE A -2 -18.184 10.528 -3.083 1.00 0.00 O ATOM 36 CB PHE A -2 -15.610 9.417 -3.711 1.00 0.00 C ATOM 37 CG PHE A -2 -15.512 8.960 -2.304 1.00 0.00 C ATOM 38 CD1 PHE A -2 -15.286 7.598 -2.034 1.00 0.00 C ATOM 39 CD2 PHE A -2 -15.740 9.812 -1.246 1.00 0.00 C ATOM 40 CE1 PHE A -2 -15.251 7.118 -0.730 1.00 0.00 C ATOM 41 CE2 PHE A -2 -15.769 9.360 0.076 1.00 0.00 C ATOM 42 CZ PHE A -2 -15.518 7.976 0.322 1.00 0.00 C ATOM 0 H PHE A -2 -17.627 10.598 -5.285 1.00 0.00 H new ATOM 0 HA PHE A -2 -16.936 7.862 -4.561 1.00 0.00 H new ATOM 0 HB2 PHE A -2 -14.775 9.024 -4.292 1.00 0.00 H new ATOM 0 HB3 PHE A -2 -15.547 10.504 -3.758 1.00 0.00 H new ATOM 0 HD1 PHE A -2 -15.137 6.913 -2.855 1.00 0.00 H new ATOM 0 HD2 PHE A -2 -15.901 10.861 -1.444 1.00 0.00 H new ATOM 0 HE1 PHE A -2 -15.017 6.081 -0.539 1.00 0.00 H new ATOM 0 HE2 PHE A -2 -15.976 10.039 0.890 1.00 0.00 H new ATOM 0 HZ PHE A -2 -15.537 7.597 1.333 1.00 0.00 H new ATOM 52 N LYS A -1 -18.642 8.298 -2.627 1.00 0.00 N ATOM 53 CA LYS A -1 -19.652 8.556 -1.596 1.00 0.00 C ATOM 54 C LYS A -1 -19.317 7.646 -0.415 1.00 0.00 C ATOM 55 O LYS A -1 -18.774 6.554 -0.631 1.00 0.00 O ATOM 56 CB LYS A -1 -21.079 8.275 -1.976 1.00 0.00 C ATOM 57 CG LYS A -1 -21.747 9.412 -2.775 1.00 0.00 C ATOM 58 CD LYS A -1 -23.281 9.219 -2.889 1.00 0.00 C ATOM 59 CE LYS A -1 -23.670 7.989 -3.679 1.00 0.00 C ATOM 60 NZ LYS A -1 -23.421 8.179 -5.140 1.00 0.00 N ATOM 0 H LYS A -1 -18.443 7.310 -2.783 1.00 0.00 H new ATOM 0 HA LYS A -1 -19.606 9.626 -1.392 1.00 0.00 H new ATOM 0 HB2 LYS A -1 -21.114 7.360 -2.567 1.00 0.00 H new ATOM 0 HB3 LYS A -1 -21.657 8.092 -1.070 1.00 0.00 H new ATOM 0 HG2 LYS A -1 -21.537 10.366 -2.292 1.00 0.00 H new ATOM 0 HG3 LYS A -1 -21.312 9.457 -3.773 1.00 0.00 H new ATOM 0 HD2 LYS A -1 -23.707 9.150 -1.888 1.00 0.00 H new ATOM 0 HD3 LYS A -1 -23.717 10.099 -3.361 1.00 0.00 H new ATOM 0 HE2 LYS A -1 -23.103 7.130 -3.320 1.00 0.00 H new ATOM 0 HE3 LYS A -1 -24.724 7.767 -3.514 1.00 0.00 H new ATOM 0 HZ1 LYS A -1 -23.698 7.318 -5.654 1.00 0.00 H new ATOM 0 HZ2 LYS A -1 -23.981 8.984 -5.486 1.00 0.00 H new ATOM 0 HZ3 LYS A -1 -22.410 8.367 -5.298 1.00 0.00 H new ATOM 74 N ALA A 0 -19.711 8.127 0.755 1.00 0.00 N ATOM 75 CA ALA A 0 -19.429 7.438 2.020 1.00 0.00 C ATOM 76 C ALA A 0 -20.132 6.074 2.068 1.00 0.00 C ATOM 77 O ALA A 0 -21.280 5.969 1.582 1.00 0.00 O ATOM 78 CB ALA A 0 -19.793 8.211 3.265 1.00 0.00 C ATOM 0 H ALA A 0 -20.231 8.998 0.862 1.00 0.00 H new ATOM 0 HA ALA A 0 -18.345 7.325 2.027 1.00 0.00 H new ATOM 0 HB1 ALA A 0 -19.547 7.618 4.146 1.00 0.00 H new ATOM 0 HB2 ALA A 0 -19.234 9.146 3.289 1.00 0.00 H new ATOM 0 HB3 ALA A 0 -20.861 8.427 3.260 1.00 0.00 H new ATOM 84 N GLY A 1 -19.471 5.185 2.812 1.00 0.00 N ATOM 85 CA GLY A 1 -19.933 3.846 3.009 1.00 0.00 C ATOM 86 C GLY A 1 -19.852 3.598 4.485 1.00 0.00 C ATOM 87 O GLY A 1 -20.063 4.457 5.389 1.00 0.00 O ATOM 0 H GLY A 1 -18.595 5.394 3.291 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -20.955 3.728 2.648 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -19.317 3.135 2.459 1.00 0.00 H new ATOM 91 N SER A 2 -19.551 2.372 4.798 1.00 0.00 N ATOM 92 CA SER A 2 -19.474 1.832 6.131 1.00 0.00 C ATOM 93 C SER A 2 -17.986 1.860 6.542 1.00 0.00 C ATOM 94 O SER A 2 -17.172 1.048 6.072 1.00 0.00 O ATOM 95 CB SER A 2 -20.005 0.392 6.176 1.00 0.00 C ATOM 96 OG SER A 2 -19.810 -0.040 7.465 1.00 0.00 O ATOM 0 H SER A 2 -19.338 1.674 4.085 1.00 0.00 H new ATOM 0 HA SER A 2 -20.086 2.422 6.814 1.00 0.00 H new ATOM 0 HB2 SER A 2 -21.061 0.356 5.907 1.00 0.00 H new ATOM 0 HB3 SER A 2 -19.474 -0.243 5.467 1.00 0.00 H new ATOM 0 HG SER A 2 -20.274 -0.893 7.598 1.00 0.00 H new ATOM 102 N ALA A 3 -17.771 2.681 7.573 1.00 0.00 N ATOM 103 CA ALA A 3 -16.425 2.725 8.187 1.00 0.00 C ATOM 104 C ALA A 3 -16.164 1.393 8.878 1.00 0.00 C ATOM 105 O ALA A 3 -14.988 0.982 9.020 1.00 0.00 O ATOM 106 CB ALA A 3 -16.244 3.829 9.199 1.00 0.00 C ATOM 0 H ALA A 3 -18.467 3.299 7.990 1.00 0.00 H new ATOM 0 HA ALA A 3 -15.721 2.921 7.378 1.00 0.00 H new ATOM 0 HB1 ALA A 3 -15.232 3.792 9.601 1.00 0.00 H new ATOM 0 HB2 ALA A 3 -16.408 4.794 8.719 1.00 0.00 H new ATOM 0 HB3 ALA A 3 -16.961 3.701 10.010 1.00 0.00 H new ATOM 112 N LYS A 4 -17.128 0.759 9.451 1.00 0.00 N ATOM 113 CA LYS A 4 -16.858 -0.491 10.162 1.00 0.00 C ATOM 114 C LYS A 4 -16.469 -1.497 9.061 1.00 0.00 C ATOM 115 O LYS A 4 -15.642 -2.337 9.301 1.00 0.00 O ATOM 116 CB LYS A 4 -17.973 -1.158 10.933 1.00 0.00 C ATOM 117 CG LYS A 4 -18.474 -0.136 11.982 1.00 0.00 C ATOM 118 CD LYS A 4 -19.669 -0.669 12.720 1.00 0.00 C ATOM 119 CE LYS A 4 -19.981 0.478 13.706 1.00 0.00 C ATOM 120 NZ LYS A 4 -21.091 0.016 14.585 1.00 0.00 N ATOM 0 H LYS A 4 -18.103 1.060 9.455 1.00 0.00 H new ATOM 0 HA LYS A 4 -16.121 -0.227 10.921 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -18.782 -1.452 10.264 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -17.616 -2.066 11.419 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -17.675 0.087 12.689 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -18.734 0.800 11.488 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -20.505 -0.869 12.050 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -19.445 -1.602 13.238 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -19.100 0.726 14.298 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -20.268 1.381 13.167 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 -21.330 0.765 15.265 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 -21.925 -0.203 14.004 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -20.794 -0.837 15.100 1.00 0.00 H new ATOM 134 N LYS A 5 -17.277 -1.530 8.011 1.00 0.00 N ATOM 135 CA LYS A 5 -16.966 -2.513 6.931 1.00 0.00 C ATOM 136 C LYS A 5 -15.566 -2.276 6.385 1.00 0.00 C ATOM 137 O LYS A 5 -14.768 -3.207 6.079 1.00 0.00 O ATOM 138 CB LYS A 5 -17.956 -2.257 5.816 1.00 0.00 C ATOM 139 CG LYS A 5 -18.103 -3.253 4.706 1.00 0.00 C ATOM 140 CD LYS A 5 -19.434 -3.997 4.730 1.00 0.00 C ATOM 141 CE LYS A 5 -19.330 -5.311 3.942 1.00 0.00 C ATOM 142 NZ LYS A 5 -17.989 -5.952 4.003 1.00 0.00 N ATOM 0 H LYS A 5 -18.099 -0.944 7.867 1.00 0.00 H new ATOM 0 HA LYS A 5 -17.026 -3.531 7.317 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -18.937 -2.134 6.275 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -17.694 -1.301 5.362 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -18.000 -2.738 3.751 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -17.290 -3.976 4.767 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -19.722 -4.206 5.760 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -20.216 -3.370 4.301 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -20.073 -6.011 4.324 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -19.581 -5.117 2.899 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -18.059 -6.936 3.674 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -17.327 -5.430 3.395 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -17.642 -5.939 4.983 1.00 0.00 H new ATOM 156 N GLY A 6 -15.255 -1.031 6.259 1.00 0.00 N ATOM 157 CA GLY A 6 -13.935 -0.433 5.768 1.00 0.00 C ATOM 158 C GLY A 6 -12.854 -0.838 6.716 1.00 0.00 C ATOM 159 O GLY A 6 -11.774 -1.228 6.124 1.00 0.00 O ATOM 0 H GLY A 6 -15.926 -0.301 6.499 1.00 0.00 H new ATOM 0 HA2 GLY A 6 -13.709 -0.786 4.762 1.00 0.00 H new ATOM 0 HA3 GLY A 6 -14.007 0.653 5.716 1.00 0.00 H new ATOM 163 N ALA A 7 -13.045 -0.912 7.988 1.00 0.00 N ATOM 164 CA ALA A 7 -12.039 -1.341 8.986 1.00 0.00 C ATOM 165 C ALA A 7 -11.678 -2.779 8.700 1.00 0.00 C ATOM 166 O ALA A 7 -10.449 -2.991 8.827 1.00 0.00 O ATOM 167 CB ALA A 7 -12.420 -1.198 10.455 1.00 0.00 C ATOM 0 H ALA A 7 -13.940 -0.670 8.414 1.00 0.00 H new ATOM 0 HA ALA A 7 -11.203 -0.652 8.865 1.00 0.00 H new ATOM 0 HB1 ALA A 7 -11.598 -1.547 11.080 1.00 0.00 H new ATOM 0 HB2 ALA A 7 -12.626 -0.151 10.677 1.00 0.00 H new ATOM 0 HB3 ALA A 7 -13.309 -1.794 10.660 1.00 0.00 H new ATOM 173 N THR A 8 -12.612 -3.618 8.432 1.00 0.00 N ATOM 174 CA THR A 8 -12.330 -5.067 8.219 1.00 0.00 C ATOM 175 C THR A 8 -11.730 -5.315 6.842 1.00 0.00 C ATOM 176 O THR A 8 -10.984 -6.295 6.698 1.00 0.00 O ATOM 177 CB THR A 8 -13.490 -6.020 8.578 1.00 0.00 C ATOM 178 OG1 THR A 8 -14.489 -5.808 7.578 1.00 0.00 O ATOM 179 CG2 THR A 8 -14.168 -5.818 9.940 1.00 0.00 C ATOM 0 H THR A 8 -13.596 -3.364 8.346 1.00 0.00 H new ATOM 0 HA THR A 8 -11.571 -5.333 8.954 1.00 0.00 H new ATOM 0 HB THR A 8 -13.057 -7.019 8.628 1.00 0.00 H new ATOM 0 HG1 THR A 8 -14.405 -4.900 7.219 1.00 0.00 H new ATOM 0 HG21 THR A 8 -14.964 -6.553 10.063 1.00 0.00 H new ATOM 0 HG22 THR A 8 -13.433 -5.943 10.735 1.00 0.00 H new ATOM 0 HG23 THR A 8 -14.590 -4.814 9.991 1.00 0.00 H new ATOM 187 N LEU A 9 -12.048 -4.406 5.953 1.00 0.00 N ATOM 188 CA LEU A 9 -11.414 -4.465 4.636 1.00 0.00 C ATOM 189 C LEU A 9 -9.950 -4.160 4.887 1.00 0.00 C ATOM 190 O LEU A 9 -9.034 -4.842 4.351 1.00 0.00 O ATOM 191 CB LEU A 9 -11.933 -3.475 3.593 1.00 0.00 C ATOM 192 CG LEU A 9 -12.061 -4.056 2.172 1.00 0.00 C ATOM 193 CD1 LEU A 9 -13.136 -5.106 2.166 1.00 0.00 C ATOM 194 CD2 LEU A 9 -12.347 -3.043 1.079 1.00 0.00 C ATOM 0 H LEU A 9 -12.711 -3.644 6.095 1.00 0.00 H new ATOM 0 HA LEU A 9 -11.627 -5.447 4.212 1.00 0.00 H new ATOM 0 HB2 LEU A 9 -12.909 -3.109 3.912 1.00 0.00 H new ATOM 0 HB3 LEU A 9 -11.264 -2.615 3.562 1.00 0.00 H new ATOM 0 HG LEU A 9 -11.081 -4.469 1.935 1.00 0.00 H new ATOM 0 HD11 LEU A 9 -13.233 -5.522 1.163 1.00 0.00 H new ATOM 0 HD12 LEU A 9 -12.873 -5.900 2.865 1.00 0.00 H new ATOM 0 HD13 LEU A 9 -14.084 -4.658 2.466 1.00 0.00 H new ATOM 0 HD21 LEU A 9 -12.418 -3.554 0.119 1.00 0.00 H new ATOM 0 HD22 LEU A 9 -13.288 -2.535 1.291 1.00 0.00 H new ATOM 0 HD23 LEU A 9 -11.540 -2.311 1.041 1.00 0.00 H new ATOM 206 N PHE A 10 -9.667 -3.147 5.610 1.00 0.00 N ATOM 207 CA PHE A 10 -8.244 -2.736 5.928 1.00 0.00 C ATOM 208 C PHE A 10 -7.470 -3.868 6.483 1.00 0.00 C ATOM 209 O PHE A 10 -6.407 -4.347 6.080 1.00 0.00 O ATOM 210 CB PHE A 10 -8.151 -1.483 6.733 1.00 0.00 C ATOM 211 CG PHE A 10 -6.688 -1.022 6.866 1.00 0.00 C ATOM 212 CD1 PHE A 10 -5.849 -1.499 7.847 1.00 0.00 C ATOM 213 CD2 PHE A 10 -6.193 -0.187 5.889 1.00 0.00 C ATOM 214 CE1 PHE A 10 -4.573 -0.964 7.979 1.00 0.00 C ATOM 215 CE2 PHE A 10 -4.863 0.296 5.929 1.00 0.00 C ATOM 216 CZ PHE A 10 -4.068 -0.112 6.985 1.00 0.00 C ATOM 0 H PHE A 10 -10.374 -2.541 6.026 1.00 0.00 H new ATOM 0 HA PHE A 10 -7.769 -2.472 4.983 1.00 0.00 H new ATOM 0 HB2 PHE A 10 -8.742 -0.698 6.261 1.00 0.00 H new ATOM 0 HB3 PHE A 10 -8.575 -1.650 7.723 1.00 0.00 H new ATOM 0 HD1 PHE A 10 -6.180 -2.284 8.510 1.00 0.00 H new ATOM 0 HD2 PHE A 10 -6.836 0.107 5.072 1.00 0.00 H new ATOM 0 HE1 PHE A 10 -3.972 -1.203 8.844 1.00 0.00 H new ATOM 0 HE2 PHE A 10 -4.484 0.958 5.164 1.00 0.00 H new ATOM 0 HZ PHE A 10 -3.045 0.230 7.045 1.00 0.00 H new ATOM 226 N LYS A 11 -8.078 -4.499 7.531 1.00 0.00 N ATOM 227 CA LYS A 11 -7.469 -5.630 8.241 1.00 0.00 C ATOM 228 C LYS A 11 -7.191 -6.750 7.317 1.00 0.00 C ATOM 229 O LYS A 11 -6.063 -7.265 7.244 1.00 0.00 O ATOM 230 CB LYS A 11 -8.254 -6.069 9.422 1.00 0.00 C ATOM 231 CG LYS A 11 -8.131 -5.078 10.593 1.00 0.00 C ATOM 232 CD LYS A 11 -8.997 -5.609 11.776 1.00 0.00 C ATOM 233 CE LYS A 11 -10.008 -4.574 12.226 1.00 0.00 C ATOM 234 NZ LYS A 11 -10.525 -4.821 13.572 1.00 0.00 N ATOM 0 H LYS A 11 -8.993 -4.230 7.892 1.00 0.00 H new ATOM 0 HA LYS A 11 -6.517 -5.274 8.635 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -9.303 -6.173 9.143 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -7.910 -7.053 9.741 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -7.090 -4.979 10.899 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -8.469 -4.087 10.289 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -9.515 -6.518 11.471 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -8.350 -5.876 12.612 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -9.546 -3.587 12.197 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -10.840 -4.558 11.522 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -11.211 -4.080 13.822 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -10.993 -5.749 13.599 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -9.739 -4.809 14.253 1.00 0.00 H new ATOM 248 N THR A 12 -8.108 -7.201 6.524 1.00 0.00 N ATOM 249 CA THR A 12 -7.840 -8.319 5.607 1.00 0.00 C ATOM 250 C THR A 12 -7.033 -7.994 4.393 1.00 0.00 C ATOM 251 O THR A 12 -6.547 -8.942 3.768 1.00 0.00 O ATOM 252 CB THR A 12 -9.199 -9.002 5.266 1.00 0.00 C ATOM 253 OG1 THR A 12 -10.089 -8.048 4.661 1.00 0.00 O ATOM 254 CG2 THR A 12 -9.928 -9.669 6.415 1.00 0.00 C ATOM 0 H THR A 12 -9.056 -6.829 6.475 1.00 0.00 H new ATOM 0 HA THR A 12 -7.181 -9.011 6.131 1.00 0.00 H new ATOM 0 HB THR A 12 -8.921 -9.809 4.588 1.00 0.00 H new ATOM 0 HG1 THR A 12 -10.503 -7.498 5.359 1.00 0.00 H new ATOM 0 HG21 THR A 12 -10.858 -10.107 6.051 1.00 0.00 H new ATOM 0 HG22 THR A 12 -9.300 -10.452 6.839 1.00 0.00 H new ATOM 0 HG23 THR A 12 -10.152 -8.928 7.183 1.00 0.00 H new ATOM 262 N ARG A 13 -6.993 -6.785 3.882 1.00 0.00 N ATOM 263 CA ARG A 13 -6.320 -6.445 2.618 1.00 0.00 C ATOM 264 C ARG A 13 -5.157 -5.499 2.668 1.00 0.00 C ATOM 265 O ARG A 13 -4.287 -5.541 1.757 1.00 0.00 O ATOM 266 CB ARG A 13 -7.311 -5.791 1.590 1.00 0.00 C ATOM 267 CG ARG A 13 -8.613 -6.609 1.505 1.00 0.00 C ATOM 268 CD ARG A 13 -8.377 -7.622 0.412 1.00 0.00 C ATOM 269 NE ARG A 13 -8.834 -7.033 -0.850 1.00 0.00 N ATOM 270 CZ ARG A 13 -8.596 -7.613 -2.019 1.00 0.00 C ATOM 271 NH1 ARG A 13 -7.725 -8.616 -2.151 1.00 0.00 N ATOM 272 NH2 ARG A 13 -9.177 -7.088 -3.091 1.00 0.00 N ATOM 0 H ARG A 13 -7.433 -5.982 4.332 1.00 0.00 H new ATOM 0 HA ARG A 13 -5.943 -7.427 2.332 1.00 0.00 H new ATOM 0 HB2 ARG A 13 -7.536 -4.768 1.892 1.00 0.00 H new ATOM 0 HB3 ARG A 13 -6.843 -5.738 0.607 1.00 0.00 H new ATOM 0 HG2 ARG A 13 -8.833 -7.098 2.454 1.00 0.00 H new ATOM 0 HG3 ARG A 13 -9.464 -5.970 1.272 1.00 0.00 H new ATOM 0 HD2 ARG A 13 -7.320 -7.880 0.352 1.00 0.00 H new ATOM 0 HD3 ARG A 13 -8.919 -8.544 0.622 1.00 0.00 H new ATOM 0 HE ARG A 13 -9.349 -6.153 -0.829 1.00 0.00 H new ATOM 0 HH11 ARG A 13 -7.217 -8.961 -1.337 1.00 0.00 H new ATOM 0 HH12 ARG A 13 -7.568 -9.038 -3.066 1.00 0.00 H new ATOM 0 HH21 ARG A 13 -9.779 -6.270 -2.996 1.00 0.00 H new ATOM 0 HH22 ARG A 13 -9.021 -7.502 -4.010 1.00 0.00 H new ATOM 286 N CYS A 14 -5.050 -4.680 3.665 1.00 0.00 N ATOM 287 CA CYS A 14 -3.962 -3.716 3.789 1.00 0.00 C ATOM 288 C CYS A 14 -2.987 -3.843 4.989 1.00 0.00 C ATOM 289 O CYS A 14 -1.886 -3.345 4.872 1.00 0.00 O ATOM 290 CB CYS A 14 -4.430 -2.302 3.787 1.00 0.00 C ATOM 291 SG CYS A 14 -5.896 -1.904 2.767 1.00 0.00 S ATOM 0 H CYS A 14 -5.717 -4.648 4.436 1.00 0.00 H new ATOM 0 HA CYS A 14 -3.400 -3.985 2.894 1.00 0.00 H new ATOM 0 HB2 CYS A 14 -4.648 -2.018 4.816 1.00 0.00 H new ATOM 0 HB3 CYS A 14 -3.605 -1.674 3.451 1.00 0.00 H new ATOM 296 N LEU A 15 -3.431 -4.348 6.094 1.00 0.00 N ATOM 297 CA LEU A 15 -2.753 -4.474 7.382 1.00 0.00 C ATOM 298 C LEU A 15 -1.420 -5.311 7.236 1.00 0.00 C ATOM 299 O LEU A 15 -0.496 -4.961 7.987 1.00 0.00 O ATOM 300 CB LEU A 15 -3.669 -5.044 8.441 1.00 0.00 C ATOM 301 CG LEU A 15 -3.045 -5.175 9.815 1.00 0.00 C ATOM 302 CD1 LEU A 15 -3.008 -3.804 10.362 1.00 0.00 C ATOM 303 CD2 LEU A 15 -3.829 -6.148 10.630 1.00 0.00 C ATOM 0 H LEU A 15 -4.376 -4.728 6.141 1.00 0.00 H new ATOM 0 HA LEU A 15 -2.477 -3.474 7.715 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -4.552 -4.410 8.517 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -4.009 -6.027 8.116 1.00 0.00 H new ATOM 0 HG LEU A 15 -2.032 -5.578 9.804 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -2.567 -3.822 11.359 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -2.408 -3.169 9.711 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -4.022 -3.408 10.421 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -3.379 -6.241 11.618 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -4.855 -5.795 10.731 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -3.827 -7.120 10.137 1.00 0.00 H new ATOM 315 N GLN A 16 -1.438 -6.154 6.283 1.00 0.00 N ATOM 316 CA GLN A 16 -0.201 -6.978 6.044 1.00 0.00 C ATOM 317 C GLN A 16 0.959 -6.035 5.773 1.00 0.00 C ATOM 318 O GLN A 16 2.076 -6.486 6.241 1.00 0.00 O ATOM 319 CB GLN A 16 -0.413 -7.958 4.930 1.00 0.00 C ATOM 320 CG GLN A 16 0.839 -8.682 4.434 1.00 0.00 C ATOM 321 CD GLN A 16 0.562 -9.154 2.997 1.00 0.00 C ATOM 322 OE1 GLN A 16 1.600 -9.698 2.415 1.00 0.00 O flip ATOM 323 NE2 GLN A 16 -0.580 -9.062 2.479 1.00 0.00 N flip ATOM 0 H GLN A 16 -2.223 -6.328 5.655 1.00 0.00 H new ATOM 0 HA GLN A 16 0.030 -7.573 6.927 1.00 0.00 H new ATOM 0 HB2 GLN A 16 -1.135 -8.705 5.261 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -0.863 -7.431 4.088 1.00 0.00 H new ATOM 0 HG2 GLN A 16 1.702 -8.016 4.459 1.00 0.00 H new ATOM 0 HG3 GLN A 16 1.072 -9.530 5.078 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -1.341 -8.623 2.997 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -0.745 -9.426 1.541 1.00 0.00 H new ATOM 332 N CYS A 17 0.711 -4.878 5.200 1.00 0.00 N ATOM 333 CA CYS A 17 1.793 -4.018 4.817 1.00 0.00 C ATOM 334 C CYS A 17 1.925 -2.661 5.413 1.00 0.00 C ATOM 335 O CYS A 17 2.836 -1.849 5.228 1.00 0.00 O ATOM 336 CB CYS A 17 1.729 -3.883 3.267 1.00 0.00 C ATOM 337 SG CYS A 17 2.129 -5.488 2.464 1.00 0.00 S ATOM 0 H CYS A 17 -0.221 -4.520 4.994 1.00 0.00 H new ATOM 0 HA CYS A 17 2.673 -4.515 5.225 1.00 0.00 H new ATOM 0 HB2 CYS A 17 0.734 -3.557 2.965 1.00 0.00 H new ATOM 0 HB3 CYS A 17 2.430 -3.118 2.933 1.00 0.00 H new ATOM 342 N HIS A 18 0.767 -2.214 6.020 1.00 0.00 N ATOM 343 CA HIS A 18 0.592 -0.837 6.521 1.00 0.00 C ATOM 344 C HIS A 18 -0.117 -0.725 7.863 1.00 0.00 C ATOM 345 O HIS A 18 -0.932 -1.539 8.274 1.00 0.00 O ATOM 346 CB HIS A 18 -0.313 -0.034 5.574 1.00 0.00 C ATOM 347 CG HIS A 18 0.079 0.225 4.144 1.00 0.00 C ATOM 348 ND1 HIS A 18 0.890 1.238 3.777 1.00 0.00 N ATOM 349 CD2 HIS A 18 -0.319 -0.404 2.981 1.00 0.00 C ATOM 350 CE1 HIS A 18 1.034 1.217 2.536 1.00 0.00 C ATOM 351 NE2 HIS A 18 0.277 0.241 1.951 1.00 0.00 N ATOM 0 H HIS A 18 -0.050 -2.807 6.164 1.00 0.00 H new ATOM 0 HA HIS A 18 1.615 -0.469 6.602 1.00 0.00 H new ATOM 0 HB2 HIS A 18 -1.277 -0.541 5.551 1.00 0.00 H new ATOM 0 HB3 HIS A 18 -0.475 0.938 6.039 1.00 0.00 H new ATOM 0 HD1 HIS A 18 1.317 1.913 4.411 1.00 0.00 H new ATOM 0 HD2 HIS A 18 -0.983 -1.253 2.907 1.00 0.00 H new ATOM 0 HE1 HIS A 18 1.679 1.890 1.991 1.00 0.00 H new ATOM 359 N THR A 19 0.272 0.339 8.511 1.00 0.00 N ATOM 360 CA THR A 19 -0.376 0.811 9.784 1.00 0.00 C ATOM 361 C THR A 19 -1.074 2.159 9.469 1.00 0.00 C ATOM 362 O THR A 19 -0.750 2.788 8.487 1.00 0.00 O ATOM 363 CB THR A 19 0.639 0.920 10.942 1.00 0.00 C ATOM 364 OG1 THR A 19 1.565 1.895 10.581 1.00 0.00 O ATOM 365 CG2 THR A 19 1.302 -0.438 11.139 1.00 0.00 C ATOM 0 H THR A 19 1.044 0.929 8.202 1.00 0.00 H new ATOM 0 HA THR A 19 -1.114 0.087 10.130 1.00 0.00 H new ATOM 0 HB THR A 19 0.166 1.200 11.883 1.00 0.00 H new ATOM 0 HG1 THR A 19 2.459 1.496 10.534 1.00 0.00 H new ATOM 0 HG21 THR A 19 2.022 -0.376 11.955 1.00 0.00 H new ATOM 0 HG22 THR A 19 0.543 -1.182 11.381 1.00 0.00 H new ATOM 0 HG23 THR A 19 1.816 -0.728 10.223 1.00 0.00 H new ATOM 373 N VAL A 20 -2.081 2.488 10.282 1.00 0.00 N ATOM 374 CA VAL A 20 -2.768 3.764 10.070 1.00 0.00 C ATOM 375 C VAL A 20 -2.667 4.776 11.204 1.00 0.00 C ATOM 376 O VAL A 20 -2.921 5.984 11.023 1.00 0.00 O ATOM 377 CB VAL A 20 -4.255 3.518 9.724 1.00 0.00 C ATOM 378 CG1 VAL A 20 -4.639 2.759 8.538 1.00 0.00 C ATOM 379 CG2 VAL A 20 -4.931 2.785 10.862 1.00 0.00 C ATOM 0 H VAL A 20 -2.426 1.921 11.056 1.00 0.00 H new ATOM 0 HA VAL A 20 -2.235 4.222 9.237 1.00 0.00 H new ATOM 0 HB VAL A 20 -4.561 4.545 9.526 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -5.726 2.702 8.479 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -4.253 3.255 7.648 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -4.226 1.752 8.601 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -5.978 2.614 10.613 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -4.435 1.828 11.023 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -4.867 3.385 11.770 1.00 0.00 H new ATOM 389 N GLU A 21 -2.285 4.289 12.314 1.00 0.00 N ATOM 390 CA GLU A 21 -2.233 5.099 13.534 1.00 0.00 C ATOM 391 C GLU A 21 -1.112 6.112 13.560 1.00 0.00 C ATOM 392 O GLU A 21 -0.026 5.947 13.094 1.00 0.00 O ATOM 393 CB GLU A 21 -2.080 4.188 14.754 1.00 0.00 C ATOM 394 CG GLU A 21 -0.879 3.228 14.562 1.00 0.00 C ATOM 395 CD GLU A 21 -1.251 1.874 13.986 1.00 0.00 C ATOM 396 OE1 GLU A 21 -2.339 1.718 13.433 1.00 0.00 O ATOM 397 OE2 GLU A 21 -0.294 0.993 14.256 1.00 0.00 O ATOM 0 H GLU A 21 -1.992 3.320 12.439 1.00 0.00 H new ATOM 0 HA GLU A 21 -3.171 5.655 13.555 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -1.933 4.791 15.650 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -2.994 3.613 14.904 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -0.151 3.702 13.904 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -0.390 3.079 15.525 1.00 0.00 H new ATOM 404 N LYS A 22 -1.390 7.205 14.252 1.00 0.00 N ATOM 405 CA LYS A 22 -0.344 8.254 14.450 1.00 0.00 C ATOM 406 C LYS A 22 0.725 7.627 15.300 1.00 0.00 C ATOM 407 O LYS A 22 0.422 7.076 16.332 1.00 0.00 O ATOM 408 CB LYS A 22 -1.005 9.339 15.262 1.00 0.00 C ATOM 409 CG LYS A 22 -0.196 10.282 16.110 1.00 0.00 C ATOM 410 CD LYS A 22 -0.137 11.552 15.323 1.00 0.00 C ATOM 411 CE LYS A 22 0.807 12.577 15.992 1.00 0.00 C ATOM 412 NZ LYS A 22 1.352 13.424 14.914 1.00 0.00 N ATOM 0 H LYS A 22 -2.293 7.407 14.682 1.00 0.00 H new ATOM 0 HA LYS A 22 0.066 8.638 13.516 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -1.580 9.950 14.567 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -1.720 8.850 15.924 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -0.664 10.441 17.081 1.00 0.00 H new ATOM 0 HG3 LYS A 22 0.802 9.887 16.298 1.00 0.00 H new ATOM 0 HD2 LYS A 22 0.209 11.341 14.311 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -1.137 11.977 15.236 1.00 0.00 H new ATOM 0 HE2 LYS A 22 0.267 13.180 16.722 1.00 0.00 H new ATOM 0 HE3 LYS A 22 1.609 12.070 16.528 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 1.996 14.132 15.321 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 1.873 12.831 14.236 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 0.572 13.907 14.424 1.00 0.00 H new ATOM 426 N GLY A 23 1.992 7.671 14.866 1.00 0.00 N ATOM 427 CA GLY A 23 3.010 6.993 15.715 1.00 0.00 C ATOM 428 C GLY A 23 3.162 5.519 15.451 1.00 0.00 C ATOM 429 O GLY A 23 3.838 4.793 16.229 1.00 0.00 O ATOM 0 H GLY A 23 2.328 8.121 14.015 1.00 0.00 H new ATOM 0 HA2 GLY A 23 3.974 7.478 15.561 1.00 0.00 H new ATOM 0 HA3 GLY A 23 2.745 7.136 16.762 1.00 0.00 H new ATOM 433 N GLY A 24 2.486 5.042 14.406 1.00 0.00 N ATOM 434 CA GLY A 24 2.528 3.684 13.883 1.00 0.00 C ATOM 435 C GLY A 24 3.834 3.660 13.003 1.00 0.00 C ATOM 436 O GLY A 24 4.213 4.663 12.382 1.00 0.00 O ATOM 0 H GLY A 24 1.854 5.636 13.870 1.00 0.00 H new ATOM 0 HA2 GLY A 24 2.573 2.948 14.685 1.00 0.00 H new ATOM 0 HA3 GLY A 24 1.642 3.456 13.290 1.00 0.00 H new ATOM 440 N PRO A 25 4.403 2.480 13.002 1.00 0.00 N ATOM 441 CA PRO A 25 5.584 2.312 12.181 1.00 0.00 C ATOM 442 C PRO A 25 5.342 1.996 10.751 1.00 0.00 C ATOM 443 O PRO A 25 4.355 1.445 10.251 1.00 0.00 O ATOM 444 CB PRO A 25 6.289 1.091 12.876 1.00 0.00 C ATOM 445 CG PRO A 25 5.154 0.222 13.278 1.00 0.00 C ATOM 446 CD PRO A 25 4.071 1.257 13.732 1.00 0.00 C ATOM 0 HA PRO A 25 6.149 3.243 12.132 1.00 0.00 H new ATOM 0 HB2 PRO A 25 6.967 0.577 12.194 1.00 0.00 H new ATOM 0 HB3 PRO A 25 6.880 1.405 13.737 1.00 0.00 H new ATOM 0 HG2 PRO A 25 4.803 -0.394 12.450 1.00 0.00 H new ATOM 0 HG3 PRO A 25 5.430 -0.456 14.086 1.00 0.00 H new ATOM 0 HD2 PRO A 25 3.066 0.911 13.490 1.00 0.00 H new ATOM 0 HD3 PRO A 25 4.103 1.417 14.810 1.00 0.00 H new ATOM 454 N HIS A 26 6.411 2.239 9.934 1.00 0.00 N ATOM 455 CA HIS A 26 6.494 1.763 8.560 1.00 0.00 C ATOM 456 C HIS A 26 6.648 0.265 8.668 1.00 0.00 C ATOM 457 O HIS A 26 7.438 -0.184 9.580 1.00 0.00 O ATOM 458 CB HIS A 26 7.593 2.410 7.749 1.00 0.00 C ATOM 459 CG HIS A 26 7.564 3.906 7.650 1.00 0.00 C ATOM 460 ND1 HIS A 26 6.334 4.563 7.411 1.00 0.00 N ATOM 461 CD2 HIS A 26 8.545 4.866 7.710 1.00 0.00 C ATOM 462 CE1 HIS A 26 6.596 5.812 7.392 1.00 0.00 C ATOM 463 NE2 HIS A 26 7.975 6.094 7.520 1.00 0.00 N ATOM 0 H HIS A 26 7.228 2.773 10.231 1.00 0.00 H new ATOM 0 HA HIS A 26 5.597 2.039 8.005 1.00 0.00 H new ATOM 0 HB2 HIS A 26 8.551 2.116 8.178 1.00 0.00 H new ATOM 0 HB3 HIS A 26 7.557 2.001 6.739 1.00 0.00 H new ATOM 0 HD2 HIS A 26 9.595 4.681 7.880 1.00 0.00 H new ATOM 0 HE1 HIS A 26 5.840 6.576 7.289 1.00 0.00 H new ATOM 0 HE2 HIS A 26 8.437 7.002 7.480 1.00 0.00 H new ATOM 471 N LYS A 27 6.073 -0.403 7.680 1.00 0.00 N ATOM 472 CA LYS A 27 6.351 -1.879 7.566 1.00 0.00 C ATOM 473 C LYS A 27 6.901 -2.098 6.193 1.00 0.00 C ATOM 474 O LYS A 27 7.785 -1.333 5.707 1.00 0.00 O ATOM 475 CB LYS A 27 5.116 -2.619 8.038 1.00 0.00 C ATOM 476 CG LYS A 27 4.754 -2.277 9.476 1.00 0.00 C ATOM 477 CD LYS A 27 3.730 -3.252 10.042 1.00 0.00 C ATOM 478 CE LYS A 27 2.566 -3.541 9.156 1.00 0.00 C ATOM 479 NZ LYS A 27 1.451 -4.078 9.968 1.00 0.00 N ATOM 0 H LYS A 27 5.449 -0.008 6.976 1.00 0.00 H new ATOM 0 HA LYS A 27 7.121 -2.299 8.213 1.00 0.00 H new ATOM 0 HB2 LYS A 27 4.277 -2.375 7.386 1.00 0.00 H new ATOM 0 HB3 LYS A 27 5.283 -3.693 7.953 1.00 0.00 H new ATOM 0 HG2 LYS A 27 5.653 -2.294 10.092 1.00 0.00 H new ATOM 0 HG3 LYS A 27 4.356 -1.263 9.521 1.00 0.00 H new ATOM 0 HD2 LYS A 27 4.234 -4.191 10.269 1.00 0.00 H new ATOM 0 HD3 LYS A 27 3.357 -2.854 10.986 1.00 0.00 H new ATOM 0 HE2 LYS A 27 2.252 -2.632 8.642 1.00 0.00 H new ATOM 0 HE3 LYS A 27 2.850 -4.260 8.387 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 0.705 -4.437 9.339 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 1.800 -4.852 10.568 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 1.064 -3.322 10.568 1.00 0.00 H new ATOM 493 N CYS A 28 6.280 -3.066 5.451 1.00 0.00 N ATOM 494 CA CYS A 28 6.533 -3.216 4.022 1.00 0.00 C ATOM 495 C CYS A 28 6.222 -1.926 3.310 1.00 0.00 C ATOM 496 O CYS A 28 6.940 -1.388 2.426 1.00 0.00 O ATOM 497 CB CYS A 28 5.645 -4.372 3.550 1.00 0.00 C ATOM 498 SG CYS A 28 6.232 -5.063 1.965 1.00 0.00 S ATOM 0 H CYS A 28 5.612 -3.736 5.833 1.00 0.00 H new ATOM 0 HA CYS A 28 7.578 -3.439 3.806 1.00 0.00 H new ATOM 0 HB2 CYS A 28 5.633 -5.156 4.308 1.00 0.00 H new ATOM 0 HB3 CYS A 28 4.619 -4.022 3.438 1.00 0.00 H new ATOM 503 N GLY A 29 4.985 -1.448 3.675 1.00 0.00 N ATOM 504 CA GLY A 29 4.523 -0.143 3.258 1.00 0.00 C ATOM 505 C GLY A 29 4.601 0.894 4.371 1.00 0.00 C ATOM 506 O GLY A 29 4.758 0.614 5.547 1.00 0.00 O ATOM 0 H GLY A 29 4.321 -1.966 4.251 1.00 0.00 H new ATOM 0 HA2 GLY A 29 5.119 0.195 2.410 1.00 0.00 H new ATOM 0 HA3 GLY A 29 3.492 -0.221 2.912 1.00 0.00 H new ATOM 510 N PRO A 30 4.495 2.198 3.949 1.00 0.00 N ATOM 511 CA PRO A 30 4.595 3.267 4.898 1.00 0.00 C ATOM 512 C PRO A 30 3.354 3.434 5.796 1.00 0.00 C ATOM 513 O PRO A 30 2.327 3.018 5.355 1.00 0.00 O ATOM 514 CB PRO A 30 4.733 4.521 4.099 1.00 0.00 C ATOM 515 CG PRO A 30 4.188 4.205 2.760 1.00 0.00 C ATOM 516 CD PRO A 30 4.350 2.691 2.581 1.00 0.00 C ATOM 0 HA PRO A 30 5.435 3.050 5.558 1.00 0.00 H new ATOM 0 HB2 PRO A 30 4.185 5.342 4.561 1.00 0.00 H new ATOM 0 HB3 PRO A 30 5.776 4.831 4.034 1.00 0.00 H new ATOM 0 HG2 PRO A 30 3.140 4.496 2.687 1.00 0.00 H new ATOM 0 HG3 PRO A 30 4.725 4.749 1.983 1.00 0.00 H new ATOM 0 HD2 PRO A 30 3.485 2.251 2.086 1.00 0.00 H new ATOM 0 HD3 PRO A 30 5.222 2.450 1.973 1.00 0.00 H new ATOM 524 N ASN A 31 3.618 3.935 6.937 1.00 0.00 N ATOM 525 CA ASN A 31 2.498 4.291 7.852 1.00 0.00 C ATOM 526 C ASN A 31 1.674 5.302 7.025 1.00 0.00 C ATOM 527 O ASN A 31 2.222 6.159 6.326 1.00 0.00 O ATOM 528 CB ASN A 31 2.965 4.820 9.186 1.00 0.00 C ATOM 529 CG ASN A 31 1.808 5.539 9.957 1.00 0.00 C ATOM 530 OD1 ASN A 31 1.715 6.794 9.834 1.00 0.00 O ATOM 531 ND2 ASN A 31 1.123 4.666 10.676 1.00 0.00 N ATOM 0 H ASN A 31 4.555 4.121 7.295 1.00 0.00 H new ATOM 0 HA ASN A 31 1.903 3.428 8.152 1.00 0.00 H new ATOM 0 HB2 ASN A 31 3.350 3.998 9.790 1.00 0.00 H new ATOM 0 HB3 ASN A 31 3.789 5.517 9.034 1.00 0.00 H new ATOM 0 HD21 ASN A 31 0.358 4.984 11.271 1.00 0.00 H new ATOM 0 HD22 ASN A 31 1.359 3.675 10.635 1.00 0.00 H new ATOM 538 N LEU A 32 0.327 5.154 7.078 1.00 0.00 N ATOM 539 CA LEU A 32 -0.504 6.091 6.360 1.00 0.00 C ATOM 540 C LEU A 32 -1.175 7.227 7.165 1.00 0.00 C ATOM 541 O LEU A 32 -2.015 7.957 6.569 1.00 0.00 O ATOM 542 CB LEU A 32 -1.599 5.280 5.631 1.00 0.00 C ATOM 543 CG LEU A 32 -1.245 4.195 4.633 1.00 0.00 C ATOM 544 CD1 LEU A 32 -2.382 3.241 4.400 1.00 0.00 C ATOM 545 CD2 LEU A 32 -0.684 4.673 3.331 1.00 0.00 C ATOM 0 H LEU A 32 -0.168 4.424 7.591 1.00 0.00 H new ATOM 0 HA LEU A 32 0.182 6.622 5.699 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -2.215 4.815 6.401 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -2.231 5.998 5.108 1.00 0.00 H new ATOM 0 HG LEU A 32 -0.428 3.664 5.121 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -2.079 2.483 3.678 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -2.651 2.759 5.340 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -3.242 3.787 4.013 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -0.466 3.817 2.693 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -1.410 5.319 2.837 1.00 0.00 H new ATOM 0 HD23 LEU A 32 0.234 5.232 3.514 1.00 0.00 H new ATOM 557 N HIS A 33 -0.854 7.395 8.418 1.00 0.00 N ATOM 558 CA HIS A 33 -1.474 8.549 9.130 1.00 0.00 C ATOM 559 C HIS A 33 -1.187 9.801 8.368 1.00 0.00 C ATOM 560 O HIS A 33 -0.022 10.032 7.879 1.00 0.00 O ATOM 561 CB HIS A 33 -0.996 8.687 10.500 1.00 0.00 C ATOM 562 CG HIS A 33 -2.090 9.235 11.423 1.00 0.00 C ATOM 563 ND1 HIS A 33 -3.098 8.431 11.875 1.00 0.00 N ATOM 564 CD2 HIS A 33 -2.228 10.526 11.920 1.00 0.00 C ATOM 565 CE1 HIS A 33 -3.826 9.222 12.645 1.00 0.00 C ATOM 566 NE2 HIS A 33 -3.359 10.501 12.644 1.00 0.00 N ATOM 0 H HIS A 33 -0.218 6.812 8.962 1.00 0.00 H new ATOM 0 HA HIS A 33 -2.547 8.367 9.185 1.00 0.00 H new ATOM 0 HB2 HIS A 33 -0.659 7.718 10.868 1.00 0.00 H new ATOM 0 HB3 HIS A 33 -0.134 9.353 10.520 1.00 0.00 H new ATOM 0 HD1 HIS A 33 -3.254 7.445 11.666 1.00 0.00 H new ATOM 0 HD2 HIS A 33 -1.569 11.366 11.759 1.00 0.00 H new ATOM 0 HE1 HIS A 33 -4.688 8.893 13.207 1.00 0.00 H new ATOM 574 N GLY A 34 -2.237 10.667 8.280 1.00 0.00 N ATOM 575 CA GLY A 34 -2.175 11.924 7.588 1.00 0.00 C ATOM 576 C GLY A 34 -2.036 11.900 6.117 1.00 0.00 C ATOM 577 O GLY A 34 -1.730 12.932 5.572 1.00 0.00 O ATOM 0 H GLY A 34 -3.146 10.481 8.703 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -3.079 12.483 7.829 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -1.335 12.487 7.994 1.00 0.00 H new ATOM 581 N ILE A 35 -2.325 10.803 5.448 1.00 0.00 N ATOM 582 CA ILE A 35 -2.191 10.637 4.010 1.00 0.00 C ATOM 583 C ILE A 35 -3.045 11.585 3.197 1.00 0.00 C ATOM 584 O ILE A 35 -2.701 12.091 2.120 1.00 0.00 O ATOM 585 CB ILE A 35 -2.322 9.194 3.550 1.00 0.00 C ATOM 586 CG1 ILE A 35 -1.835 9.072 2.127 1.00 0.00 C ATOM 587 CG2 ILE A 35 -3.680 8.585 3.698 1.00 0.00 C ATOM 588 CD1 ILE A 35 -0.348 8.723 1.918 1.00 0.00 C ATOM 0 H ILE A 35 -2.676 9.964 5.910 1.00 0.00 H new ATOM 0 HA ILE A 35 -1.161 10.926 3.803 1.00 0.00 H new ATOM 0 HB ILE A 35 -1.696 8.615 4.229 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -2.434 8.309 1.629 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -2.035 10.016 1.620 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -3.658 7.556 3.340 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -3.972 8.598 4.748 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -4.401 9.157 3.114 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -0.134 8.667 0.851 1.00 0.00 H new ATOM 0 HD12 ILE A 35 0.274 9.494 2.373 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -0.131 7.761 2.383 1.00 0.00 H new ATOM 600 N PHE A 36 -4.217 11.817 3.727 1.00 0.00 N ATOM 601 CA PHE A 36 -5.165 12.744 3.022 1.00 0.00 C ATOM 602 C PHE A 36 -4.647 14.156 2.978 1.00 0.00 C ATOM 603 O PHE A 36 -4.268 14.689 4.020 1.00 0.00 O ATOM 604 CB PHE A 36 -6.548 12.552 3.646 1.00 0.00 C ATOM 605 CG PHE A 36 -7.062 11.222 3.229 1.00 0.00 C ATOM 606 CD1 PHE A 36 -7.351 11.003 1.902 1.00 0.00 C ATOM 607 CD2 PHE A 36 -7.109 10.214 4.174 1.00 0.00 C ATOM 608 CE1 PHE A 36 -7.873 9.787 1.496 1.00 0.00 C ATOM 609 CE2 PHE A 36 -7.612 8.949 3.778 1.00 0.00 C ATOM 610 CZ PHE A 36 -7.998 8.762 2.447 1.00 0.00 C ATOM 0 H PHE A 36 -4.559 11.416 4.600 1.00 0.00 H new ATOM 0 HA PHE A 36 -5.254 12.500 1.963 1.00 0.00 H new ATOM 0 HB2 PHE A 36 -6.487 12.613 4.733 1.00 0.00 H new ATOM 0 HB3 PHE A 36 -7.226 13.341 3.320 1.00 0.00 H new ATOM 0 HD1 PHE A 36 -7.170 11.781 1.176 1.00 0.00 H new ATOM 0 HD2 PHE A 36 -6.772 10.385 5.186 1.00 0.00 H new ATOM 0 HE1 PHE A 36 -8.177 9.630 0.472 1.00 0.00 H new ATOM 0 HE2 PHE A 36 -7.696 8.143 4.492 1.00 0.00 H new ATOM 0 HZ PHE A 36 -8.401 7.807 2.144 1.00 0.00 H new ATOM 620 N GLY A 37 -4.597 14.695 1.798 1.00 0.00 N ATOM 621 CA GLY A 37 -4.057 16.051 1.567 1.00 0.00 C ATOM 622 C GLY A 37 -2.540 16.159 1.336 1.00 0.00 C ATOM 623 O GLY A 37 -2.030 17.234 1.011 1.00 0.00 O ATOM 0 H GLY A 37 -4.923 14.228 0.952 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -4.564 16.477 0.701 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -4.316 16.671 2.425 1.00 0.00 H new ATOM 627 N ARG A 38 -1.827 15.096 1.580 1.00 0.00 N ATOM 628 CA ARG A 38 -0.328 15.046 1.411 1.00 0.00 C ATOM 629 C ARG A 38 -0.100 14.489 0.051 1.00 0.00 C ATOM 630 O ARG A 38 -1.036 13.879 -0.558 1.00 0.00 O ATOM 631 CB ARG A 38 0.306 14.350 2.594 1.00 0.00 C ATOM 632 CG ARG A 38 1.645 13.682 2.525 1.00 0.00 C ATOM 633 CD ARG A 38 2.142 13.136 3.820 1.00 0.00 C ATOM 634 NE ARG A 38 1.889 11.713 3.956 1.00 0.00 N ATOM 635 CZ ARG A 38 1.656 11.095 5.098 1.00 0.00 C ATOM 636 NH1 ARG A 38 1.744 11.781 6.257 1.00 0.00 N ATOM 637 NH2 ARG A 38 1.386 9.796 5.155 1.00 0.00 N ATOM 0 H ARG A 38 -2.231 14.217 1.904 1.00 0.00 H new ATOM 0 HA ARG A 38 0.178 16.011 1.435 1.00 0.00 H new ATOM 0 HB2 ARG A 38 0.370 15.091 3.391 1.00 0.00 H new ATOM 0 HB3 ARG A 38 -0.403 13.590 2.922 1.00 0.00 H new ATOM 0 HG2 ARG A 38 1.592 12.869 1.801 1.00 0.00 H new ATOM 0 HG3 ARG A 38 2.373 14.399 2.146 1.00 0.00 H new ATOM 0 HD2 ARG A 38 3.213 13.321 3.902 1.00 0.00 H new ATOM 0 HD3 ARG A 38 1.663 13.667 4.643 1.00 0.00 H new ATOM 0 HE ARG A 38 1.892 11.149 3.106 1.00 0.00 H new ATOM 0 HH11 ARG A 38 1.989 12.771 6.246 1.00 0.00 H new ATOM 0 HH12 ARG A 38 1.565 11.309 7.144 1.00 0.00 H new ATOM 0 HH21 ARG A 38 1.354 9.244 4.298 1.00 0.00 H new ATOM 0 HH22 ARG A 38 1.211 9.351 6.056 1.00 0.00 H new ATOM 651 N HIS A 39 1.072 14.772 -0.507 1.00 0.00 N ATOM 652 CA HIS A 39 1.398 14.237 -1.840 1.00 0.00 C ATOM 653 C HIS A 39 2.097 12.889 -1.566 1.00 0.00 C ATOM 654 O HIS A 39 2.551 12.600 -0.425 1.00 0.00 O ATOM 655 CB HIS A 39 2.304 15.183 -2.637 1.00 0.00 C ATOM 656 CG HIS A 39 1.660 16.478 -3.057 1.00 0.00 C ATOM 657 ND1 HIS A 39 1.597 17.583 -2.221 1.00 0.00 N ATOM 658 CD2 HIS A 39 1.114 16.842 -4.275 1.00 0.00 C ATOM 659 CE1 HIS A 39 1.003 18.512 -2.929 1.00 0.00 C ATOM 660 NE2 HIS A 39 0.717 18.151 -4.161 1.00 0.00 N ATOM 0 H HIS A 39 1.797 15.349 -0.080 1.00 0.00 H new ATOM 0 HA HIS A 39 0.504 14.121 -2.452 1.00 0.00 H new ATOM 0 HB2 HIS A 39 3.184 15.411 -2.036 1.00 0.00 H new ATOM 0 HB3 HIS A 39 2.653 14.662 -3.529 1.00 0.00 H new ATOM 0 HD2 HIS A 39 1.018 16.215 -5.149 1.00 0.00 H new ATOM 0 HE1 HIS A 39 0.768 19.490 -2.535 1.00 0.00 H new ATOM 0 HE2 HIS A 39 0.287 18.727 -4.885 1.00 0.00 H new ATOM 668 N SER A 40 2.113 12.107 -2.621 1.00 0.00 N ATOM 669 CA SER A 40 2.756 10.783 -2.606 1.00 0.00 C ATOM 670 C SER A 40 4.301 10.930 -2.404 1.00 0.00 C ATOM 671 O SER A 40 4.892 11.930 -2.769 1.00 0.00 O ATOM 672 CB SER A 40 2.466 10.006 -3.834 1.00 0.00 C ATOM 673 OG SER A 40 2.896 10.717 -4.995 1.00 0.00 O ATOM 0 H SER A 40 1.688 12.354 -3.515 1.00 0.00 H new ATOM 0 HA SER A 40 2.337 10.228 -1.767 1.00 0.00 H new ATOM 0 HB2 SER A 40 2.969 9.040 -3.786 1.00 0.00 H new ATOM 0 HB3 SER A 40 1.397 9.806 -3.899 1.00 0.00 H new ATOM 0 HG SER A 40 3.614 10.217 -5.437 1.00 0.00 H new ATOM 679 N GLY A 41 4.843 9.938 -1.710 1.00 0.00 N ATOM 680 CA GLY A 41 6.305 9.927 -1.453 1.00 0.00 C ATOM 681 C GLY A 41 6.843 10.822 -0.381 1.00 0.00 C ATOM 682 O GLY A 41 8.061 11.135 -0.399 1.00 0.00 O ATOM 0 H GLY A 41 4.327 9.149 -1.320 1.00 0.00 H new ATOM 0 HA2 GLY A 41 6.592 8.904 -1.208 1.00 0.00 H new ATOM 0 HA3 GLY A 41 6.808 10.184 -2.385 1.00 0.00 H new ATOM 686 N GLN A 42 6.113 11.227 0.627 1.00 0.00 N ATOM 687 CA GLN A 42 6.558 12.230 1.608 1.00 0.00 C ATOM 688 C GLN A 42 6.623 11.853 3.074 1.00 0.00 C ATOM 689 O GLN A 42 6.903 12.678 4.015 1.00 0.00 O ATOM 690 CB GLN A 42 5.797 13.554 1.505 1.00 0.00 C ATOM 691 CG GLN A 42 5.741 14.228 0.168 1.00 0.00 C ATOM 692 CD GLN A 42 6.824 14.983 -0.483 1.00 0.00 C ATOM 693 OE1 GLN A 42 6.867 15.049 -1.753 1.00 0.00 O ATOM 694 NE2 GLN A 42 7.650 15.656 0.298 1.00 0.00 N ATOM 0 H GLN A 42 5.173 10.873 0.807 1.00 0.00 H new ATOM 0 HA GLN A 42 7.596 12.320 1.287 1.00 0.00 H new ATOM 0 HB2 GLN A 42 4.773 13.378 1.834 1.00 0.00 H new ATOM 0 HB3 GLN A 42 6.243 14.252 2.213 1.00 0.00 H new ATOM 0 HG2 GLN A 42 5.465 13.447 -0.540 1.00 0.00 H new ATOM 0 HG3 GLN A 42 4.899 14.918 0.225 1.00 0.00 H new ATOM 0 HE21 GLN A 42 7.577 15.571 1.312 1.00 0.00 H new ATOM 0 HE22 GLN A 42 8.361 16.261 -0.113 1.00 0.00 H new ATOM 703 N ALA A 43 6.223 10.613 3.366 1.00 0.00 N ATOM 704 CA ALA A 43 6.392 10.077 4.732 1.00 0.00 C ATOM 705 C ALA A 43 7.947 9.949 4.972 1.00 0.00 C ATOM 706 O ALA A 43 8.784 9.365 4.229 1.00 0.00 O ATOM 707 CB ALA A 43 5.820 8.688 4.833 1.00 0.00 C ATOM 0 H ALA A 43 5.791 9.972 2.701 1.00 0.00 H new ATOM 0 HA ALA A 43 5.893 10.728 5.449 1.00 0.00 H new ATOM 0 HB1 ALA A 43 5.955 8.312 5.847 1.00 0.00 H new ATOM 0 HB2 ALA A 43 4.757 8.714 4.594 1.00 0.00 H new ATOM 0 HB3 ALA A 43 6.334 8.031 4.131 1.00 0.00 H new ATOM 713 N GLU A 44 8.404 10.497 6.123 1.00 0.00 N ATOM 714 CA GLU A 44 9.868 10.405 6.322 1.00 0.00 C ATOM 715 C GLU A 44 10.267 9.049 6.879 1.00 0.00 C ATOM 716 O GLU A 44 9.510 8.386 7.589 1.00 0.00 O ATOM 717 CB GLU A 44 10.596 11.486 7.072 1.00 0.00 C ATOM 718 CG GLU A 44 10.127 12.185 8.300 1.00 0.00 C ATOM 719 CD GLU A 44 11.238 13.117 8.794 1.00 0.00 C ATOM 720 OE1 GLU A 44 12.419 12.796 8.718 1.00 0.00 O ATOM 721 OE2 GLU A 44 10.706 14.255 9.177 1.00 0.00 O ATOM 0 H GLU A 44 7.856 10.956 6.851 1.00 0.00 H new ATOM 0 HA GLU A 44 10.207 10.561 5.298 1.00 0.00 H new ATOM 0 HB2 GLU A 44 11.564 11.059 7.332 1.00 0.00 H new ATOM 0 HB3 GLU A 44 10.781 12.273 6.341 1.00 0.00 H new ATOM 0 HG2 GLU A 44 9.223 12.756 8.087 1.00 0.00 H new ATOM 0 HG3 GLU A 44 9.872 11.460 9.073 1.00 0.00 H new ATOM 728 N GLY A 45 11.492 8.590 6.411 1.00 0.00 N ATOM 729 CA GLY A 45 12.037 7.353 6.852 1.00 0.00 C ATOM 730 C GLY A 45 11.610 6.145 6.057 1.00 0.00 C ATOM 731 O GLY A 45 11.864 5.035 6.542 1.00 0.00 O ATOM 0 H GLY A 45 12.071 9.092 5.738 1.00 0.00 H new ATOM 0 HA2 GLY A 45 13.124 7.422 6.822 1.00 0.00 H new ATOM 0 HA3 GLY A 45 11.755 7.201 7.894 1.00 0.00 H new ATOM 735 N TYR A 46 10.934 6.392 4.955 1.00 0.00 N ATOM 736 CA TYR A 46 10.499 5.338 4.070 1.00 0.00 C ATOM 737 C TYR A 46 11.142 5.502 2.699 1.00 0.00 C ATOM 738 O TYR A 46 11.229 6.513 2.067 1.00 0.00 O ATOM 739 CB TYR A 46 8.959 5.356 3.907 1.00 0.00 C ATOM 740 CG TYR A 46 8.508 4.103 3.180 1.00 0.00 C ATOM 741 CD1 TYR A 46 8.377 2.898 3.878 1.00 0.00 C ATOM 742 CD2 TYR A 46 8.304 4.150 1.790 1.00 0.00 C ATOM 743 CE1 TYR A 46 8.084 1.723 3.222 1.00 0.00 C ATOM 744 CE2 TYR A 46 7.964 2.979 1.140 1.00 0.00 C ATOM 745 CZ TYR A 46 7.852 1.758 1.830 1.00 0.00 C ATOM 746 OH TYR A 46 7.578 0.646 1.104 1.00 0.00 O ATOM 0 H TYR A 46 10.672 7.329 4.650 1.00 0.00 H new ATOM 0 HA TYR A 46 10.802 4.387 4.509 1.00 0.00 H new ATOM 0 HB2 TYR A 46 8.481 5.413 4.885 1.00 0.00 H new ATOM 0 HB3 TYR A 46 8.653 6.242 3.350 1.00 0.00 H new ATOM 0 HD1 TYR A 46 8.508 2.889 4.950 1.00 0.00 H new ATOM 0 HD2 TYR A 46 8.410 5.076 1.245 1.00 0.00 H new ATOM 0 HE1 TYR A 46 8.033 0.790 3.764 1.00 0.00 H new ATOM 0 HE2 TYR A 46 7.780 3.002 0.076 1.00 0.00 H new ATOM 0 HH TYR A 46 7.128 -0.013 1.673 1.00 0.00 H new ATOM 756 N SER A 47 11.583 4.302 2.211 1.00 0.00 N ATOM 757 CA SER A 47 12.162 4.216 0.900 1.00 0.00 C ATOM 758 C SER A 47 11.211 3.910 -0.224 1.00 0.00 C ATOM 759 O SER A 47 10.863 2.813 -0.714 1.00 0.00 O ATOM 760 CB SER A 47 13.400 3.181 1.014 1.00 0.00 C ATOM 761 OG SER A 47 13.711 3.030 -0.315 1.00 0.00 O ATOM 0 H SER A 47 11.536 3.419 2.719 1.00 0.00 H new ATOM 0 HA SER A 47 12.504 5.207 0.601 1.00 0.00 H new ATOM 0 HB2 SER A 47 14.230 3.587 1.592 1.00 0.00 H new ATOM 0 HB3 SER A 47 13.114 2.240 1.484 1.00 0.00 H new ATOM 0 HG SER A 47 14.467 2.413 -0.406 1.00 0.00 H new ATOM 767 N TYR A 48 10.583 4.993 -0.732 1.00 0.00 N ATOM 768 CA TYR A 48 9.630 4.870 -1.862 1.00 0.00 C ATOM 769 C TYR A 48 10.354 4.524 -3.173 1.00 0.00 C ATOM 770 O TYR A 48 11.523 4.915 -3.267 1.00 0.00 O ATOM 771 CB TYR A 48 8.989 6.233 -2.118 1.00 0.00 C ATOM 772 CG TYR A 48 8.052 6.574 -0.957 1.00 0.00 C ATOM 773 CD1 TYR A 48 6.710 6.145 -1.075 1.00 0.00 C ATOM 774 CD2 TYR A 48 8.374 7.525 -0.053 1.00 0.00 C ATOM 775 CE1 TYR A 48 5.805 6.571 -0.098 1.00 0.00 C ATOM 776 CE2 TYR A 48 7.527 7.906 0.997 1.00 0.00 C ATOM 777 CZ TYR A 48 6.201 7.415 0.914 1.00 0.00 C ATOM 778 OH TYR A 48 5.318 7.885 1.851 1.00 0.00 O ATOM 0 H TYR A 48 10.713 5.944 -0.388 1.00 0.00 H new ATOM 0 HA TYR A 48 8.912 4.094 -1.594 1.00 0.00 H new ATOM 0 HB2 TYR A 48 9.759 6.998 -2.216 1.00 0.00 H new ATOM 0 HB3 TYR A 48 8.434 6.217 -3.056 1.00 0.00 H new ATOM 0 HD1 TYR A 48 6.395 5.511 -1.891 1.00 0.00 H new ATOM 0 HD2 TYR A 48 9.332 8.016 -0.144 1.00 0.00 H new ATOM 0 HE1 TYR A 48 4.780 6.233 -0.138 1.00 0.00 H new ATOM 0 HE2 TYR A 48 7.862 8.530 1.812 1.00 0.00 H new ATOM 0 HH TYR A 48 4.415 7.899 1.471 1.00 0.00 H new ATOM 788 N THR A 49 9.685 4.035 -4.170 1.00 0.00 N ATOM 789 CA THR A 49 10.129 3.874 -5.491 1.00 0.00 C ATOM 790 C THR A 49 10.174 5.305 -6.161 1.00 0.00 C ATOM 791 O THR A 49 9.580 6.217 -5.659 1.00 0.00 O ATOM 792 CB THR A 49 9.227 3.012 -6.395 1.00 0.00 C ATOM 793 OG1 THR A 49 7.957 3.646 -6.530 1.00 0.00 O ATOM 794 CG2 THR A 49 9.143 1.564 -5.956 1.00 0.00 C ATOM 0 H THR A 49 8.725 3.712 -4.052 1.00 0.00 H new ATOM 0 HA THR A 49 11.091 3.367 -5.415 1.00 0.00 H new ATOM 0 HB THR A 49 9.683 2.951 -7.383 1.00 0.00 H new ATOM 0 HG1 THR A 49 7.269 3.094 -6.104 1.00 0.00 H new ATOM 0 HG21 THR A 49 8.492 1.015 -6.636 1.00 0.00 H new ATOM 0 HG22 THR A 49 10.139 1.121 -5.970 1.00 0.00 H new ATOM 0 HG23 THR A 49 8.738 1.513 -4.946 1.00 0.00 H new ATOM 802 N ASP A 50 11.014 5.346 -7.223 1.00 0.00 N ATOM 803 CA ASP A 50 11.196 6.532 -8.021 1.00 0.00 C ATOM 804 C ASP A 50 9.764 6.950 -8.547 1.00 0.00 C ATOM 805 O ASP A 50 9.621 8.155 -8.486 1.00 0.00 O ATOM 806 CB ASP A 50 12.128 6.349 -9.224 1.00 0.00 C ATOM 807 CG ASP A 50 13.598 6.549 -8.984 1.00 0.00 C ATOM 808 OD1 ASP A 50 14.051 6.962 -7.829 1.00 0.00 O ATOM 809 OD2 ASP A 50 14.497 6.361 -9.867 1.00 0.00 O ATOM 0 H ASP A 50 11.572 4.549 -7.531 1.00 0.00 H new ATOM 0 HA ASP A 50 11.668 7.288 -7.393 1.00 0.00 H new ATOM 0 HB2 ASP A 50 11.982 5.342 -9.615 1.00 0.00 H new ATOM 0 HB3 ASP A 50 11.815 7.043 -10.004 1.00 0.00 H new ATOM 814 N ALA A 51 9.055 5.974 -9.019 1.00 0.00 N ATOM 815 CA ALA A 51 7.711 6.021 -9.602 1.00 0.00 C ATOM 816 C ALA A 51 6.655 6.702 -8.754 1.00 0.00 C ATOM 817 O ALA A 51 5.869 7.595 -9.193 1.00 0.00 O ATOM 818 CB ALA A 51 7.217 4.614 -9.938 1.00 0.00 C ATOM 0 H ALA A 51 9.421 5.022 -9.015 1.00 0.00 H new ATOM 0 HA ALA A 51 7.836 6.631 -10.496 1.00 0.00 H new ATOM 0 HB1 ALA A 51 6.218 4.673 -10.369 1.00 0.00 H new ATOM 0 HB2 ALA A 51 7.895 4.152 -10.655 1.00 0.00 H new ATOM 0 HB3 ALA A 51 7.185 4.013 -9.029 1.00 0.00 H new ATOM 824 N ASN A 52 6.622 6.309 -7.483 1.00 0.00 N ATOM 825 CA ASN A 52 5.628 6.958 -6.578 1.00 0.00 C ATOM 826 C ASN A 52 5.914 8.415 -6.348 1.00 0.00 C ATOM 827 O ASN A 52 5.037 9.340 -6.424 1.00 0.00 O ATOM 828 CB ASN A 52 5.532 6.158 -5.289 1.00 0.00 C ATOM 829 CG ASN A 52 4.803 6.893 -4.163 1.00 0.00 C ATOM 830 OD1 ASN A 52 5.271 7.922 -3.591 1.00 0.00 O ATOM 831 ND2 ASN A 52 3.720 6.311 -3.781 1.00 0.00 N ATOM 0 H ASN A 52 7.218 5.597 -7.061 1.00 0.00 H new ATOM 0 HA ASN A 52 4.652 6.947 -7.064 1.00 0.00 H new ATOM 0 HB2 ASN A 52 5.016 5.219 -5.492 1.00 0.00 H new ATOM 0 HB3 ASN A 52 6.537 5.904 -4.954 1.00 0.00 H new ATOM 0 HD21 ASN A 52 3.198 6.677 -2.985 1.00 0.00 H new ATOM 0 HD22 ASN A 52 3.384 5.484 -4.275 1.00 0.00 H new ATOM 838 N ILE A 53 7.125 8.721 -6.041 1.00 0.00 N ATOM 839 CA ILE A 53 7.536 10.095 -5.774 1.00 0.00 C ATOM 840 C ILE A 53 7.287 11.131 -6.875 1.00 0.00 C ATOM 841 O ILE A 53 7.038 12.293 -6.528 1.00 0.00 O ATOM 842 CB ILE A 53 9.085 9.997 -5.571 1.00 0.00 C ATOM 843 CG1 ILE A 53 9.419 9.248 -4.288 1.00 0.00 C ATOM 844 CG2 ILE A 53 9.740 11.331 -5.569 1.00 0.00 C ATOM 845 CD1 ILE A 53 10.807 9.389 -3.623 1.00 0.00 C ATOM 0 H ILE A 53 7.878 8.038 -5.962 1.00 0.00 H new ATOM 0 HA ILE A 53 6.942 10.453 -4.933 1.00 0.00 H new ATOM 0 HB ILE A 53 9.477 9.439 -6.421 1.00 0.00 H new ATOM 0 HG12 ILE A 53 8.678 9.541 -3.545 1.00 0.00 H new ATOM 0 HG13 ILE A 53 9.267 8.187 -4.489 1.00 0.00 H new ATOM 0 HG21 ILE A 53 10.814 11.209 -5.425 1.00 0.00 H new ATOM 0 HG22 ILE A 53 9.556 11.828 -6.521 1.00 0.00 H new ATOM 0 HG23 ILE A 53 9.332 11.936 -4.759 1.00 0.00 H new ATOM 0 HD11 ILE A 53 10.843 8.776 -2.722 1.00 0.00 H new ATOM 0 HD12 ILE A 53 11.579 9.058 -4.318 1.00 0.00 H new ATOM 0 HD13 ILE A 53 10.980 10.432 -3.359 1.00 0.00 H new ATOM 857 N LYS A 54 7.542 10.766 -8.091 1.00 0.00 N ATOM 858 CA LYS A 54 7.524 11.584 -9.302 1.00 0.00 C ATOM 859 C LYS A 54 6.106 11.679 -9.874 1.00 0.00 C ATOM 860 O LYS A 54 5.872 12.538 -10.691 1.00 0.00 O ATOM 861 CB LYS A 54 8.384 10.932 -10.414 1.00 0.00 C ATOM 862 CG LYS A 54 9.840 10.679 -10.103 1.00 0.00 C ATOM 863 CD LYS A 54 10.932 11.532 -10.760 1.00 0.00 C ATOM 864 CE LYS A 54 12.024 10.593 -11.259 1.00 0.00 C ATOM 865 NZ LYS A 54 13.058 11.231 -12.117 1.00 0.00 N ATOM 0 H LYS A 54 7.794 9.800 -8.300 1.00 0.00 H new ATOM 0 HA LYS A 54 7.907 12.565 -9.022 1.00 0.00 H new ATOM 0 HB2 LYS A 54 7.925 9.980 -10.681 1.00 0.00 H new ATOM 0 HB3 LYS A 54 8.333 11.569 -11.297 1.00 0.00 H new ATOM 0 HG2 LYS A 54 9.961 10.776 -9.024 1.00 0.00 H new ATOM 0 HG3 LYS A 54 10.048 9.639 -10.355 1.00 0.00 H new ATOM 0 HD2 LYS A 54 10.519 12.110 -11.587 1.00 0.00 H new ATOM 0 HD3 LYS A 54 11.340 12.246 -10.045 1.00 0.00 H new ATOM 0 HE2 LYS A 54 12.516 10.142 -10.397 1.00 0.00 H new ATOM 0 HE3 LYS A 54 11.557 9.783 -11.820 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 13.756 10.517 -12.408 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 12.606 11.637 -12.961 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 13.535 11.985 -11.583 1.00 0.00 H new ATOM 879 N LYS A 55 5.302 10.797 -9.381 1.00 0.00 N ATOM 880 CA LYS A 55 3.889 10.731 -9.744 1.00 0.00 C ATOM 881 C LYS A 55 3.194 11.915 -9.029 1.00 0.00 C ATOM 882 O LYS A 55 2.277 12.550 -9.573 1.00 0.00 O ATOM 883 CB LYS A 55 3.332 9.331 -9.515 1.00 0.00 C ATOM 884 CG LYS A 55 1.832 9.326 -9.374 1.00 0.00 C ATOM 885 CD LYS A 55 1.147 9.369 -10.721 1.00 0.00 C ATOM 886 CE LYS A 55 -0.342 9.548 -10.566 1.00 0.00 C ATOM 887 NZ LYS A 55 -0.980 8.923 -11.754 1.00 0.00 N ATOM 0 H LYS A 55 5.590 10.087 -8.708 1.00 0.00 H new ATOM 0 HA LYS A 55 3.700 10.865 -10.809 1.00 0.00 H new ATOM 0 HB2 LYS A 55 3.618 8.688 -10.348 1.00 0.00 H new ATOM 0 HB3 LYS A 55 3.780 8.907 -8.616 1.00 0.00 H new ATOM 0 HG2 LYS A 55 1.520 8.432 -8.835 1.00 0.00 H new ATOM 0 HG3 LYS A 55 1.519 10.183 -8.778 1.00 0.00 H new ATOM 0 HD2 LYS A 55 1.555 10.187 -11.314 1.00 0.00 H new ATOM 0 HD3 LYS A 55 1.351 8.447 -11.266 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -0.693 9.078 -9.647 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -0.599 10.605 -10.502 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -2.005 9.098 -11.730 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 -0.579 9.335 -12.621 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 -0.804 7.898 -11.744 1.00 0.00 H new ATOM 901 N ASN A 56 3.712 12.342 -7.913 1.00 0.00 N ATOM 902 CA ASN A 56 3.332 13.442 -7.081 1.00 0.00 C ATOM 903 C ASN A 56 1.815 13.531 -6.953 1.00 0.00 C ATOM 904 O ASN A 56 1.415 14.663 -7.062 1.00 0.00 O ATOM 905 CB ASN A 56 3.945 14.817 -7.471 1.00 0.00 C ATOM 906 CG ASN A 56 4.043 15.945 -6.455 1.00 0.00 C ATOM 907 OD1 ASN A 56 4.215 15.689 -5.163 1.00 0.00 O flip ATOM 908 ND2 ASN A 56 4.012 17.194 -6.789 1.00 0.00 N flip ATOM 0 H ASN A 56 4.518 11.859 -7.516 1.00 0.00 H new ATOM 0 HA ASN A 56 3.768 13.216 -6.108 1.00 0.00 H new ATOM 0 HB2 ASN A 56 4.955 14.625 -7.834 1.00 0.00 H new ATOM 0 HB3 ASN A 56 3.369 15.196 -8.315 1.00 0.00 H new ATOM 0 HD21 ASN A 56 3.883 17.458 -7.766 1.00 0.00 H new ATOM 0 HD22 ASN A 56 4.117 17.915 -6.076 1.00 0.00 H new ATOM 915 N VAL A 57 1.151 12.407 -6.700 1.00 0.00 N ATOM 916 CA VAL A 57 -0.290 12.488 -6.430 1.00 0.00 C ATOM 917 C VAL A 57 -0.693 13.204 -5.139 1.00 0.00 C ATOM 918 O VAL A 57 -0.108 13.064 -4.030 1.00 0.00 O ATOM 919 CB VAL A 57 -0.834 11.042 -6.345 1.00 0.00 C ATOM 920 CG1 VAL A 57 -2.349 11.051 -6.401 1.00 0.00 C ATOM 921 CG2 VAL A 57 -0.179 10.222 -7.427 1.00 0.00 C ATOM 0 H VAL A 57 1.557 11.472 -6.675 1.00 0.00 H new ATOM 0 HA VAL A 57 -0.707 13.082 -7.243 1.00 0.00 H new ATOM 0 HB VAL A 57 -0.583 10.576 -5.392 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -2.721 10.028 -6.340 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -2.741 11.630 -5.565 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -2.676 11.501 -7.338 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -0.550 9.198 -7.383 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -0.413 10.651 -8.401 1.00 0.00 H new ATOM 0 HG23 VAL A 57 0.901 10.223 -7.281 1.00 0.00 H new ATOM 931 N LEU A 58 -1.752 14.064 -5.263 1.00 0.00 N ATOM 932 CA LEU A 58 -2.287 14.686 -4.063 1.00 0.00 C ATOM 933 C LEU A 58 -3.420 13.685 -3.681 1.00 0.00 C ATOM 934 O LEU A 58 -4.420 13.429 -4.387 1.00 0.00 O ATOM 935 CB LEU A 58 -2.682 16.108 -4.182 1.00 0.00 C ATOM 936 CG LEU A 58 -3.013 17.040 -3.030 1.00 0.00 C ATOM 937 CD1 LEU A 58 -4.384 17.008 -2.430 1.00 0.00 C ATOM 938 CD2 LEU A 58 -2.059 17.016 -1.844 1.00 0.00 C ATOM 0 H LEU A 58 -2.212 14.316 -6.138 1.00 0.00 H new ATOM 0 HA LEU A 58 -1.543 14.816 -3.277 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -1.875 16.593 -4.731 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -3.559 16.117 -4.830 1.00 0.00 H new ATOM 0 HG LEU A 58 -2.913 17.951 -3.620 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -4.444 17.736 -1.621 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -5.122 17.253 -3.194 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -4.586 16.012 -2.037 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -2.401 17.723 -1.088 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -2.033 16.013 -1.418 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -1.059 17.295 -2.176 1.00 0.00 H new ATOM 950 N TRP A 59 -3.261 13.131 -2.499 1.00 0.00 N ATOM 951 CA TRP A 59 -4.169 12.110 -2.026 1.00 0.00 C ATOM 952 C TRP A 59 -5.457 12.706 -1.427 1.00 0.00 C ATOM 953 O TRP A 59 -5.429 13.324 -0.394 1.00 0.00 O ATOM 954 CB TRP A 59 -3.489 11.192 -1.031 1.00 0.00 C ATOM 955 CG TRP A 59 -2.354 10.308 -1.508 1.00 0.00 C ATOM 956 CD1 TRP A 59 -1.042 10.358 -1.134 1.00 0.00 C ATOM 957 CD2 TRP A 59 -2.461 9.323 -2.498 1.00 0.00 C ATOM 958 NE1 TRP A 59 -0.335 9.406 -1.820 1.00 0.00 N ATOM 959 CE2 TRP A 59 -1.140 8.736 -2.644 1.00 0.00 C ATOM 960 CE3 TRP A 59 -3.509 8.862 -3.324 1.00 0.00 C ATOM 961 CZ2 TRP A 59 -0.895 7.713 -3.566 1.00 0.00 C ATOM 962 CZ3 TRP A 59 -3.247 7.849 -4.207 1.00 0.00 C ATOM 963 CH2 TRP A 59 -1.934 7.269 -4.316 1.00 0.00 C ATOM 0 H TRP A 59 -2.512 13.370 -1.849 1.00 0.00 H new ATOM 0 HA TRP A 59 -4.460 11.521 -2.895 1.00 0.00 H new ATOM 0 HB2 TRP A 59 -3.106 11.811 -0.220 1.00 0.00 H new ATOM 0 HB3 TRP A 59 -4.254 10.544 -0.604 1.00 0.00 H new ATOM 0 HD1 TRP A 59 -0.626 11.042 -0.409 1.00 0.00 H new ATOM 0 HE1 TRP A 59 0.665 9.234 -1.715 1.00 0.00 H new ATOM 0 HE3 TRP A 59 -4.495 9.298 -3.261 1.00 0.00 H new ATOM 0 HZ2 TRP A 59 0.092 7.289 -3.677 1.00 0.00 H new ATOM 0 HZ3 TRP A 59 -4.043 7.477 -4.835 1.00 0.00 H new ATOM 0 HH2 TRP A 59 -1.772 6.460 -5.013 1.00 0.00 H new ATOM 974 N ASP A 60 -6.493 12.414 -2.138 1.00 0.00 N ATOM 975 CA ASP A 60 -7.895 12.903 -1.767 1.00 0.00 C ATOM 976 C ASP A 60 -8.713 11.625 -1.824 1.00 0.00 C ATOM 977 O ASP A 60 -8.184 10.674 -2.471 1.00 0.00 O ATOM 978 CB ASP A 60 -8.360 14.025 -2.693 1.00 0.00 C ATOM 979 CG ASP A 60 -8.640 13.487 -4.014 1.00 0.00 C ATOM 980 OD1 ASP A 60 -9.185 12.441 -4.204 1.00 0.00 O ATOM 981 OD2 ASP A 60 -8.246 14.164 -5.023 1.00 0.00 O ATOM 0 H ASP A 60 -6.458 11.846 -2.985 1.00 0.00 H new ATOM 0 HA ASP A 60 -7.976 13.374 -0.788 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -9.253 14.498 -2.286 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -7.593 14.796 -2.759 1.00 0.00 H new ATOM 986 N GLU A 61 -9.839 11.569 -1.167 1.00 0.00 N ATOM 987 CA GLU A 61 -10.713 10.340 -1.211 1.00 0.00 C ATOM 988 C GLU A 61 -10.960 9.881 -2.589 1.00 0.00 C ATOM 989 O GLU A 61 -11.153 8.676 -3.016 1.00 0.00 O ATOM 990 CB GLU A 61 -12.043 10.679 -0.479 1.00 0.00 C ATOM 991 CG GLU A 61 -12.622 12.083 -0.751 1.00 0.00 C ATOM 992 CD GLU A 61 -14.075 12.461 -0.737 1.00 0.00 C ATOM 993 OE1 GLU A 61 -14.463 12.509 0.521 1.00 0.00 O ATOM 994 OE2 GLU A 61 -14.817 12.729 -1.692 1.00 0.00 O ATOM 0 H GLU A 61 -10.204 12.328 -0.591 1.00 0.00 H new ATOM 0 HA GLU A 61 -10.205 9.514 -0.712 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -12.790 9.938 -0.762 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -11.882 10.575 0.594 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -12.140 12.744 -0.030 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -12.255 12.366 -1.738 1.00 0.00 H new ATOM 1001 N ASN A 62 -10.858 10.777 -3.568 1.00 0.00 N ATOM 1002 CA ASN A 62 -11.155 10.498 -4.976 1.00 0.00 C ATOM 1003 C ASN A 62 -10.069 9.804 -5.850 1.00 0.00 C ATOM 1004 O ASN A 62 -10.284 8.990 -6.752 1.00 0.00 O ATOM 1005 CB ASN A 62 -11.650 11.781 -5.631 1.00 0.00 C ATOM 1006 CG ASN A 62 -12.948 12.463 -5.229 1.00 0.00 C ATOM 1007 OD1 ASN A 62 -13.741 12.085 -4.344 1.00 0.00 O ATOM 1008 ND2 ASN A 62 -13.203 13.614 -5.864 1.00 0.00 N ATOM 0 H ASN A 62 -10.560 11.739 -3.404 1.00 0.00 H new ATOM 0 HA ASN A 62 -11.917 9.720 -4.935 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -10.859 12.520 -5.504 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -11.725 11.575 -6.699 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -14.030 14.159 -5.620 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -12.570 13.946 -6.592 1.00 0.00 H new ATOM 1015 N ASN A 63 -8.835 10.231 -5.722 1.00 0.00 N ATOM 1016 CA ASN A 63 -7.568 9.797 -6.323 1.00 0.00 C ATOM 1017 C ASN A 63 -7.246 8.360 -5.847 1.00 0.00 C ATOM 1018 O ASN A 63 -6.878 7.404 -6.487 1.00 0.00 O ATOM 1019 CB ASN A 63 -6.489 10.725 -5.672 1.00 0.00 C ATOM 1020 CG ASN A 63 -5.683 11.354 -6.745 1.00 0.00 C ATOM 1021 OD1 ASN A 63 -4.816 10.702 -7.445 1.00 0.00 O ATOM 1022 ND2 ASN A 63 -5.894 12.642 -6.987 1.00 0.00 N ATOM 0 H ASN A 63 -8.658 11.016 -5.096 1.00 0.00 H new ATOM 0 HA ASN A 63 -7.601 9.835 -7.412 1.00 0.00 H new ATOM 0 HB2 ASN A 63 -6.969 11.491 -5.063 1.00 0.00 H new ATOM 0 HB3 ASN A 63 -5.846 10.147 -5.008 1.00 0.00 H new ATOM 0 HD21 ASN A 63 -5.372 13.115 -7.725 1.00 0.00 H new ATOM 0 HD22 ASN A 63 -6.579 13.159 -6.435 1.00 0.00 H new ATOM 1029 N MET A 64 -7.494 8.363 -4.527 1.00 0.00 N ATOM 1030 CA MET A 64 -7.375 7.127 -3.705 1.00 0.00 C ATOM 1031 C MET A 64 -8.237 6.038 -4.251 1.00 0.00 C ATOM 1032 O MET A 64 -7.805 4.894 -4.323 1.00 0.00 O ATOM 1033 CB MET A 64 -7.619 7.382 -2.226 1.00 0.00 C ATOM 1034 CG MET A 64 -7.340 6.024 -1.552 1.00 0.00 C ATOM 1035 SD MET A 64 -5.648 5.813 -1.144 1.00 0.00 S ATOM 1036 CE MET A 64 -5.331 7.172 -0.011 1.00 0.00 C ATOM 0 H MET A 64 -7.775 9.192 -4.003 1.00 0.00 H new ATOM 0 HA MET A 64 -6.341 6.788 -3.774 1.00 0.00 H new ATOM 0 HB2 MET A 64 -6.958 8.159 -1.842 1.00 0.00 H new ATOM 0 HB3 MET A 64 -8.641 7.714 -2.043 1.00 0.00 H new ATOM 0 HG2 MET A 64 -7.942 5.941 -0.647 1.00 0.00 H new ATOM 0 HG3 MET A 64 -7.653 5.220 -2.218 1.00 0.00 H new ATOM 0 HE1 MET A 64 -4.530 6.895 0.674 1.00 0.00 H new ATOM 0 HE2 MET A 64 -5.036 8.056 -0.576 1.00 0.00 H new ATOM 0 HE3 MET A 64 -6.235 7.390 0.557 1.00 0.00 H new ATOM 1046 N SER A 65 -9.435 6.372 -4.702 1.00 0.00 N ATOM 1047 CA SER A 65 -10.344 5.349 -5.272 1.00 0.00 C ATOM 1048 C SER A 65 -9.820 4.747 -6.567 1.00 0.00 C ATOM 1049 O SER A 65 -9.882 3.534 -6.779 1.00 0.00 O ATOM 1050 CB SER A 65 -11.807 5.869 -5.492 1.00 0.00 C ATOM 1051 OG SER A 65 -12.717 4.928 -5.879 1.00 0.00 O ATOM 0 H SER A 65 -9.810 7.320 -4.693 1.00 0.00 H new ATOM 0 HA SER A 65 -10.375 4.567 -4.513 1.00 0.00 H new ATOM 0 HB2 SER A 65 -12.155 6.324 -4.565 1.00 0.00 H new ATOM 0 HB3 SER A 65 -11.784 6.657 -6.245 1.00 0.00 H new ATOM 0 HG SER A 65 -13.596 5.348 -5.988 1.00 0.00 H new ATOM 1057 N GLU A 66 -9.269 5.645 -7.407 1.00 0.00 N ATOM 1058 CA GLU A 66 -8.788 5.247 -8.709 1.00 0.00 C ATOM 1059 C GLU A 66 -7.473 4.403 -8.490 1.00 0.00 C ATOM 1060 O GLU A 66 -7.280 3.427 -9.117 1.00 0.00 O ATOM 1061 CB GLU A 66 -8.449 6.365 -9.661 1.00 0.00 C ATOM 1062 CG GLU A 66 -9.302 6.948 -10.805 1.00 0.00 C ATOM 1063 CD GLU A 66 -9.986 8.221 -10.389 1.00 0.00 C ATOM 1064 OE1 GLU A 66 -10.170 8.446 -9.158 1.00 0.00 O ATOM 1065 OE2 GLU A 66 -10.500 9.004 -11.322 1.00 0.00 O ATOM 0 H GLU A 66 -9.155 6.636 -7.194 1.00 0.00 H new ATOM 0 HA GLU A 66 -9.610 4.700 -9.172 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -8.216 7.217 -9.022 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -7.517 6.058 -10.135 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -8.669 7.140 -11.671 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -10.049 6.216 -11.113 1.00 0.00 H new ATOM 1072 N TYR A 67 -6.701 4.907 -7.546 1.00 0.00 N ATOM 1073 CA TYR A 67 -5.459 4.180 -7.155 1.00 0.00 C ATOM 1074 C TYR A 67 -5.787 2.750 -6.750 1.00 0.00 C ATOM 1075 O TYR A 67 -5.284 1.679 -7.261 1.00 0.00 O ATOM 1076 CB TYR A 67 -4.685 4.987 -6.114 1.00 0.00 C ATOM 1077 CG TYR A 67 -3.394 4.345 -5.599 1.00 0.00 C ATOM 1078 CD1 TYR A 67 -2.367 3.960 -6.483 1.00 0.00 C ATOM 1079 CD2 TYR A 67 -3.270 4.081 -4.237 1.00 0.00 C ATOM 1080 CE1 TYR A 67 -1.189 3.403 -5.970 1.00 0.00 C ATOM 1081 CE2 TYR A 67 -2.131 3.393 -3.754 1.00 0.00 C ATOM 1082 CZ TYR A 67 -1.106 3.115 -4.642 1.00 0.00 C ATOM 1083 OH TYR A 67 0.113 2.585 -4.171 1.00 0.00 O ATOM 0 H TYR A 67 -6.880 5.776 -7.042 1.00 0.00 H new ATOM 0 HA TYR A 67 -4.786 4.085 -8.007 1.00 0.00 H new ATOM 0 HB2 TYR A 67 -4.439 5.958 -6.544 1.00 0.00 H new ATOM 0 HB3 TYR A 67 -5.341 5.172 -5.263 1.00 0.00 H new ATOM 0 HD1 TYR A 67 -2.487 4.093 -7.548 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -4.041 4.400 -3.551 1.00 0.00 H new ATOM 0 HE1 TYR A 67 -0.352 3.203 -6.623 1.00 0.00 H new ATOM 0 HE2 TYR A 67 -2.063 3.093 -2.719 1.00 0.00 H new ATOM 0 HH TYR A 67 -0.065 1.792 -3.624 1.00 0.00 H new ATOM 1093 N LEU A 68 -6.682 2.577 -5.764 1.00 0.00 N ATOM 1094 CA LEU A 68 -7.085 1.297 -5.237 1.00 0.00 C ATOM 1095 C LEU A 68 -7.712 0.367 -6.222 1.00 0.00 C ATOM 1096 O LEU A 68 -7.653 -0.894 -6.139 1.00 0.00 O ATOM 1097 CB LEU A 68 -7.936 1.390 -3.912 1.00 0.00 C ATOM 1098 CG LEU A 68 -7.151 2.005 -2.777 1.00 0.00 C ATOM 1099 CD1 LEU A 68 -8.013 2.132 -1.535 1.00 0.00 C ATOM 1100 CD2 LEU A 68 -5.881 1.305 -2.416 1.00 0.00 C ATOM 0 H LEU A 68 -7.150 3.360 -5.308 1.00 0.00 H new ATOM 0 HA LEU A 68 -6.129 0.842 -4.976 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -8.831 1.984 -4.097 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -8.269 0.393 -3.624 1.00 0.00 H new ATOM 0 HG LEU A 68 -6.857 2.983 -3.159 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -7.428 2.577 -0.730 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -8.873 2.766 -1.752 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -8.358 1.144 -1.229 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -5.398 1.829 -1.591 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -6.103 0.281 -2.115 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -5.214 1.293 -3.278 1.00 0.00 H new ATOM 1112 N THR A 69 -8.183 0.931 -7.356 1.00 0.00 N ATOM 1113 CA THR A 69 -8.718 0.062 -8.387 1.00 0.00 C ATOM 1114 C THR A 69 -7.680 -0.841 -9.009 1.00 0.00 C ATOM 1115 O THR A 69 -7.948 -1.940 -9.422 1.00 0.00 O ATOM 1116 CB THR A 69 -9.431 0.883 -9.529 1.00 0.00 C ATOM 1117 OG1 THR A 69 -10.303 1.644 -8.801 1.00 0.00 O ATOM 1118 CG2 THR A 69 -10.069 -0.125 -10.472 1.00 0.00 C ATOM 0 H THR A 69 -8.199 1.930 -7.561 1.00 0.00 H new ATOM 0 HA THR A 69 -9.446 -0.567 -7.874 1.00 0.00 H new ATOM 0 HB THR A 69 -8.820 1.516 -10.172 1.00 0.00 H new ATOM 0 HG1 THR A 69 -10.820 2.217 -9.405 1.00 0.00 H new ATOM 0 HG21 THR A 69 -10.575 0.403 -11.280 1.00 0.00 H new ATOM 0 HG22 THR A 69 -9.297 -0.772 -10.889 1.00 0.00 H new ATOM 0 HG23 THR A 69 -10.792 -0.729 -9.924 1.00 0.00 H new ATOM 1126 N ASN A 70 -6.493 -0.256 -9.156 1.00 0.00 N ATOM 1127 CA ASN A 70 -5.353 -0.862 -9.840 1.00 0.00 C ATOM 1128 C ASN A 70 -4.159 0.057 -9.690 1.00 0.00 C ATOM 1129 O ASN A 70 -3.908 0.939 -10.561 1.00 0.00 O ATOM 1130 CB ASN A 70 -5.737 -1.050 -11.307 1.00 0.00 C ATOM 1131 CG ASN A 70 -4.862 -2.146 -11.865 1.00 0.00 C ATOM 1132 OD1 ASN A 70 -3.626 -2.109 -11.719 1.00 0.00 O ATOM 1133 ND2 ASN A 70 -5.529 -3.163 -12.425 1.00 0.00 N ATOM 0 H ASN A 70 -6.293 0.676 -8.793 1.00 0.00 H new ATOM 0 HA ASN A 70 -5.091 -1.831 -9.416 1.00 0.00 H new ATOM 0 HB2 ASN A 70 -6.790 -1.316 -11.397 1.00 0.00 H new ATOM 0 HB3 ASN A 70 -5.594 -0.124 -11.863 1.00 0.00 H new ATOM 0 HD21 ASN A 70 -5.022 -3.979 -12.766 1.00 0.00 H new ATOM 0 HD22 ASN A 70 -6.545 -3.121 -12.510 1.00 0.00 H new ATOM 1140 N PRO A 71 -3.466 -0.175 -8.567 1.00 0.00 N ATOM 1141 CA PRO A 71 -2.302 0.572 -8.156 1.00 0.00 C ATOM 1142 C PRO A 71 -1.225 0.758 -9.241 1.00 0.00 C ATOM 1143 O PRO A 71 -0.855 1.897 -9.465 1.00 0.00 O ATOM 1144 CB PRO A 71 -1.860 -0.184 -6.885 1.00 0.00 C ATOM 1145 CG PRO A 71 -3.158 -0.677 -6.259 1.00 0.00 C ATOM 1146 CD PRO A 71 -3.869 -1.158 -7.538 1.00 0.00 C ATOM 0 HA PRO A 71 -2.514 1.623 -7.959 1.00 0.00 H new ATOM 0 HB2 PRO A 71 -1.197 -1.014 -7.128 1.00 0.00 H new ATOM 0 HB3 PRO A 71 -1.315 0.470 -6.204 1.00 0.00 H new ATOM 0 HG2 PRO A 71 -3.000 -1.478 -5.537 1.00 0.00 H new ATOM 0 HG3 PRO A 71 -3.705 0.113 -5.744 1.00 0.00 H new ATOM 0 HD2 PRO A 71 -3.561 -2.168 -7.809 1.00 0.00 H new ATOM 0 HD3 PRO A 71 -4.951 -1.179 -7.409 1.00 0.00 H new ATOM 1154 N LYS A 72 -0.854 -0.350 -9.864 1.00 0.00 N ATOM 1155 CA LYS A 72 0.182 -0.347 -10.918 1.00 0.00 C ATOM 1156 C LYS A 72 -0.186 0.304 -12.225 1.00 0.00 C ATOM 1157 O LYS A 72 0.623 0.819 -12.952 1.00 0.00 O ATOM 1158 CB LYS A 72 0.578 -1.805 -11.225 1.00 0.00 C ATOM 1159 CG LYS A 72 1.475 -2.192 -10.048 1.00 0.00 C ATOM 1160 CD LYS A 72 2.085 -3.597 -10.215 1.00 0.00 C ATOM 1161 CE LYS A 72 2.938 -3.839 -8.954 1.00 0.00 C ATOM 1162 NZ LYS A 72 3.990 -4.842 -9.183 1.00 0.00 N ATOM 0 H LYS A 72 -1.248 -1.270 -9.667 1.00 0.00 H new ATOM 0 HA LYS A 72 0.989 0.257 -10.503 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -0.297 -2.452 -11.292 1.00 0.00 H new ATOM 0 HB3 LYS A 72 1.107 -1.885 -12.175 1.00 0.00 H new ATOM 0 HG2 LYS A 72 2.276 -1.460 -9.949 1.00 0.00 H new ATOM 0 HG3 LYS A 72 0.895 -2.157 -9.126 1.00 0.00 H new ATOM 0 HD2 LYS A 72 1.305 -4.353 -10.310 1.00 0.00 H new ATOM 0 HD3 LYS A 72 2.695 -3.653 -11.116 1.00 0.00 H new ATOM 0 HE2 LYS A 72 3.394 -2.900 -8.640 1.00 0.00 H new ATOM 0 HE3 LYS A 72 2.294 -4.169 -8.139 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 4.540 -4.974 -8.310 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 3.554 -5.745 -9.458 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 4.621 -4.516 -9.943 1.00 0.00 H new ATOM 1176 N LYS A 73 -1.521 0.354 -12.460 1.00 0.00 N ATOM 1177 CA LYS A 73 -2.072 1.020 -13.667 1.00 0.00 C ATOM 1178 C LYS A 73 -1.963 2.485 -13.325 1.00 0.00 C ATOM 1179 O LYS A 73 -1.495 3.183 -14.254 1.00 0.00 O ATOM 1180 CB LYS A 73 -3.441 0.526 -14.061 1.00 0.00 C ATOM 1181 CG LYS A 73 -4.046 0.962 -15.387 1.00 0.00 C ATOM 1182 CD LYS A 73 -3.246 0.815 -16.648 1.00 0.00 C ATOM 1183 CE LYS A 73 -3.939 1.368 -17.905 1.00 0.00 C ATOM 1184 NZ LYS A 73 -3.078 1.899 -18.977 1.00 0.00 N ATOM 0 H LYS A 73 -2.225 -0.051 -11.842 1.00 0.00 H new ATOM 0 HA LYS A 73 -1.526 0.791 -14.582 1.00 0.00 H new ATOM 0 HB2 LYS A 73 -3.407 -0.563 -14.061 1.00 0.00 H new ATOM 0 HB3 LYS A 73 -4.134 0.823 -13.274 1.00 0.00 H new ATOM 0 HG2 LYS A 73 -4.973 0.405 -15.522 1.00 0.00 H new ATOM 0 HG3 LYS A 73 -4.317 2.014 -15.293 1.00 0.00 H new ATOM 0 HD2 LYS A 73 -2.291 1.324 -16.520 1.00 0.00 H new ATOM 0 HD3 LYS A 73 -3.026 -0.241 -16.804 1.00 0.00 H new ATOM 0 HE2 LYS A 73 -4.552 0.573 -18.329 1.00 0.00 H new ATOM 0 HE3 LYS A 73 -4.617 2.162 -17.594 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 -3.670 2.238 -19.762 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 -2.509 2.687 -18.607 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 -2.446 1.147 -19.319 1.00 0.00 H new ATOM 1198 N TYR A 74 -2.260 2.899 -12.124 1.00 0.00 N ATOM 1199 CA TYR A 74 -2.204 4.299 -11.664 1.00 0.00 C ATOM 1200 C TYR A 74 -0.803 4.871 -11.477 1.00 0.00 C ATOM 1201 O TYR A 74 -0.511 6.013 -11.839 1.00 0.00 O ATOM 1202 CB TYR A 74 -3.053 4.363 -10.339 1.00 0.00 C ATOM 1203 CG TYR A 74 -3.405 5.805 -10.060 1.00 0.00 C ATOM 1204 CD1 TYR A 74 -4.448 6.452 -10.792 1.00 0.00 C ATOM 1205 CD2 TYR A 74 -2.690 6.577 -9.146 1.00 0.00 C ATOM 1206 CE1 TYR A 74 -4.641 7.803 -10.723 1.00 0.00 C ATOM 1207 CE2 TYR A 74 -2.969 7.920 -8.999 1.00 0.00 C ATOM 1208 CZ TYR A 74 -3.944 8.530 -9.780 1.00 0.00 C ATOM 1209 OH TYR A 74 -4.192 9.841 -9.600 1.00 0.00 O ATOM 0 H TYR A 74 -2.563 2.258 -11.391 1.00 0.00 H new ATOM 0 HA TYR A 74 -2.614 4.939 -12.446 1.00 0.00 H new ATOM 0 HB2 TYR A 74 -3.959 3.766 -10.441 1.00 0.00 H new ATOM 0 HB3 TYR A 74 -2.487 3.944 -9.507 1.00 0.00 H new ATOM 0 HD1 TYR A 74 -5.100 5.858 -11.415 1.00 0.00 H new ATOM 0 HD2 TYR A 74 -1.913 6.121 -8.550 1.00 0.00 H new ATOM 0 HE1 TYR A 74 -5.328 8.294 -11.396 1.00 0.00 H new ATOM 0 HE2 TYR A 74 -2.425 8.503 -8.270 1.00 0.00 H new ATOM 0 HH TYR A 74 -4.523 9.989 -8.690 1.00 0.00 H new ATOM 1219 N ILE A 75 0.095 4.085 -10.840 1.00 0.00 N ATOM 1220 CA ILE A 75 1.548 4.430 -10.634 1.00 0.00 C ATOM 1221 C ILE A 75 2.406 3.319 -11.160 1.00 0.00 C ATOM 1222 O ILE A 75 2.850 2.304 -10.533 1.00 0.00 O ATOM 1223 CB ILE A 75 1.972 4.774 -9.240 1.00 0.00 C ATOM 1224 CG1 ILE A 75 0.834 5.569 -8.545 1.00 0.00 C ATOM 1225 CG2 ILE A 75 3.259 5.551 -9.297 1.00 0.00 C ATOM 1226 CD1 ILE A 75 1.209 6.245 -7.208 1.00 0.00 C ATOM 0 H ILE A 75 -0.157 3.179 -10.444 1.00 0.00 H new ATOM 0 HA ILE A 75 1.684 5.358 -11.190 1.00 0.00 H new ATOM 0 HB ILE A 75 2.153 3.874 -8.653 1.00 0.00 H new ATOM 0 HG12 ILE A 75 0.480 6.337 -9.233 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -0.001 4.892 -8.367 1.00 0.00 H new ATOM 0 HG21 ILE A 75 3.575 5.806 -8.285 1.00 0.00 H new ATOM 0 HG22 ILE A 75 4.029 4.946 -9.776 1.00 0.00 H new ATOM 0 HG23 ILE A 75 3.107 6.465 -9.871 1.00 0.00 H new ATOM 0 HD11 ILE A 75 0.341 6.772 -6.811 1.00 0.00 H new ATOM 0 HD12 ILE A 75 1.531 5.486 -6.495 1.00 0.00 H new ATOM 0 HD13 ILE A 75 2.020 6.955 -7.374 1.00 0.00 H new ATOM 1238 N PRO A 76 2.654 3.386 -12.474 1.00 0.00 N ATOM 1239 CA PRO A 76 3.358 2.313 -13.137 1.00 0.00 C ATOM 1240 C PRO A 76 4.826 2.368 -12.506 1.00 0.00 C ATOM 1241 O PRO A 76 5.465 3.409 -12.499 1.00 0.00 O ATOM 1242 CB PRO A 76 3.280 2.612 -14.594 1.00 0.00 C ATOM 1243 CG PRO A 76 2.298 3.775 -14.701 1.00 0.00 C ATOM 1244 CD PRO A 76 2.274 4.525 -13.381 1.00 0.00 C ATOM 0 HA PRO A 76 2.967 1.304 -13.008 1.00 0.00 H new ATOM 0 HB2 PRO A 76 4.257 2.881 -14.995 1.00 0.00 H new ATOM 0 HB3 PRO A 76 2.931 1.747 -15.157 1.00 0.00 H new ATOM 0 HG2 PRO A 76 2.594 4.444 -15.509 1.00 0.00 H new ATOM 0 HG3 PRO A 76 1.301 3.405 -14.942 1.00 0.00 H new ATOM 0 HD2 PRO A 76 2.987 5.348 -13.349 1.00 0.00 H new ATOM 0 HD3 PRO A 76 1.294 4.943 -13.149 1.00 0.00 H new ATOM 1252 N GLY A 77 5.169 1.165 -12.077 1.00 0.00 N ATOM 1253 CA GLY A 77 6.482 1.006 -11.413 1.00 0.00 C ATOM 1254 C GLY A 77 6.435 0.974 -9.912 1.00 0.00 C ATOM 1255 O GLY A 77 7.455 0.924 -9.193 1.00 0.00 O ATOM 0 H GLY A 77 4.605 0.320 -12.161 1.00 0.00 H new ATOM 0 HA2 GLY A 77 6.942 0.083 -11.767 1.00 0.00 H new ATOM 0 HA3 GLY A 77 7.131 1.825 -11.724 1.00 0.00 H new ATOM 1259 N THR A 78 5.232 1.121 -9.281 1.00 0.00 N ATOM 1260 CA THR A 78 5.123 1.161 -7.815 1.00 0.00 C ATOM 1261 C THR A 78 5.490 -0.182 -7.337 1.00 0.00 C ATOM 1262 O THR A 78 5.204 -1.114 -8.107 1.00 0.00 O ATOM 1263 CB THR A 78 3.693 1.650 -7.381 1.00 0.00 C ATOM 1264 OG1 THR A 78 3.750 1.628 -5.969 1.00 0.00 O ATOM 1265 CG2 THR A 78 2.674 0.773 -8.014 1.00 0.00 C ATOM 0 H THR A 78 4.342 1.212 -9.770 1.00 0.00 H new ATOM 0 HA THR A 78 5.798 1.885 -7.359 1.00 0.00 H new ATOM 0 HB THR A 78 3.405 2.650 -7.705 1.00 0.00 H new ATOM 0 HG1 THR A 78 2.891 1.924 -5.602 1.00 0.00 H new ATOM 0 HG21 THR A 78 1.677 1.102 -7.720 1.00 0.00 H new ATOM 0 HG22 THR A 78 2.769 0.828 -9.098 1.00 0.00 H new ATOM 0 HG23 THR A 78 2.827 -0.256 -7.688 1.00 0.00 H new ATOM 1273 N LYS A 79 6.101 -0.365 -6.197 1.00 0.00 N ATOM 1274 CA LYS A 79 6.388 -1.639 -5.673 1.00 0.00 C ATOM 1275 C LYS A 79 5.361 -2.182 -4.748 1.00 0.00 C ATOM 1276 O LYS A 79 5.518 -3.216 -4.116 1.00 0.00 O ATOM 1277 CB LYS A 79 7.681 -1.673 -4.827 1.00 0.00 C ATOM 1278 CG LYS A 79 7.708 -0.790 -3.640 1.00 0.00 C ATOM 1279 CD LYS A 79 9.116 -0.772 -3.004 1.00 0.00 C ATOM 1280 CE LYS A 79 9.264 0.347 -2.045 1.00 0.00 C ATOM 1281 NZ LYS A 79 10.380 0.287 -1.068 1.00 0.00 N ATOM 0 H LYS A 79 6.415 0.402 -5.603 1.00 0.00 H new ATOM 0 HA LYS A 79 6.455 -2.231 -6.586 1.00 0.00 H new ATOM 0 HB2 LYS A 79 7.847 -2.698 -4.495 1.00 0.00 H new ATOM 0 HB3 LYS A 79 8.519 -1.407 -5.471 1.00 0.00 H new ATOM 0 HG2 LYS A 79 7.420 0.221 -3.927 1.00 0.00 H new ATOM 0 HG3 LYS A 79 6.977 -1.134 -2.908 1.00 0.00 H new ATOM 0 HD2 LYS A 79 9.297 -1.717 -2.493 1.00 0.00 H new ATOM 0 HD3 LYS A 79 9.869 -0.684 -3.787 1.00 0.00 H new ATOM 0 HE2 LYS A 79 9.373 1.267 -2.620 1.00 0.00 H new ATOM 0 HE3 LYS A 79 8.333 0.430 -1.484 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 10.895 1.191 -1.073 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 9.999 0.111 -0.116 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 11.029 -0.483 -1.329 1.00 0.00 H new ATOM 1295 N MET A 80 4.236 -1.413 -4.710 1.00 0.00 N ATOM 1296 CA MET A 80 3.040 -1.932 -3.928 1.00 0.00 C ATOM 1297 C MET A 80 2.415 -3.074 -4.697 1.00 0.00 C ATOM 1298 O MET A 80 1.831 -2.758 -5.751 1.00 0.00 O ATOM 1299 CB MET A 80 1.980 -0.837 -3.669 1.00 0.00 C ATOM 1300 CG MET A 80 0.583 -1.275 -3.164 1.00 0.00 C ATOM 1301 SD MET A 80 -0.286 -0.061 -2.334 1.00 0.00 S ATOM 1302 CE MET A 80 -1.958 -0.660 -2.603 1.00 0.00 C ATOM 0 H MET A 80 4.117 -0.507 -5.163 1.00 0.00 H new ATOM 0 HA MET A 80 3.396 -2.267 -2.954 1.00 0.00 H new ATOM 0 HB2 MET A 80 2.393 -0.139 -2.941 1.00 0.00 H new ATOM 0 HB3 MET A 80 1.840 -0.283 -4.597 1.00 0.00 H new ATOM 0 HG2 MET A 80 -0.009 -1.609 -4.016 1.00 0.00 H new ATOM 0 HG3 MET A 80 0.703 -2.134 -2.503 1.00 0.00 H new ATOM 0 HE1 MET A 80 -2.667 0.006 -2.111 1.00 0.00 H new ATOM 0 HE2 MET A 80 -2.167 -0.686 -3.672 1.00 0.00 H new ATOM 0 HE3 MET A 80 -2.056 -1.664 -2.189 1.00 0.00 H new ATOM 1312 N ALA A 81 2.654 -4.266 -4.161 1.00 0.00 N ATOM 1313 CA ALA A 81 2.133 -5.493 -4.731 1.00 0.00 C ATOM 1314 C ALA A 81 0.708 -5.858 -4.271 1.00 0.00 C ATOM 1315 O ALA A 81 0.420 -6.800 -3.488 1.00 0.00 O ATOM 1316 CB ALA A 81 3.009 -6.748 -4.522 1.00 0.00 C ATOM 0 H ALA A 81 3.214 -4.404 -3.320 1.00 0.00 H new ATOM 0 HA ALA A 81 2.131 -5.233 -5.790 1.00 0.00 H new ATOM 0 HB1 ALA A 81 2.528 -7.609 -4.987 1.00 0.00 H new ATOM 0 HB2 ALA A 81 3.987 -6.589 -4.977 1.00 0.00 H new ATOM 0 HB3 ALA A 81 3.131 -6.933 -3.455 1.00 0.00 H new ATOM 1322 N PHE A 82 -0.251 -5.100 -4.823 1.00 0.00 N ATOM 1323 CA PHE A 82 -1.668 -5.263 -4.513 1.00 0.00 C ATOM 1324 C PHE A 82 -2.405 -5.157 -5.839 1.00 0.00 C ATOM 1325 O PHE A 82 -2.218 -4.180 -6.575 1.00 0.00 O ATOM 1326 CB PHE A 82 -2.126 -4.225 -3.450 1.00 0.00 C ATOM 1327 CG PHE A 82 -3.640 -4.230 -3.202 1.00 0.00 C ATOM 1328 CD1 PHE A 82 -4.222 -5.250 -2.512 1.00 0.00 C ATOM 1329 CD2 PHE A 82 -4.417 -3.190 -3.735 1.00 0.00 C ATOM 1330 CE1 PHE A 82 -5.596 -5.250 -2.229 1.00 0.00 C ATOM 1331 CE2 PHE A 82 -5.777 -3.144 -3.459 1.00 0.00 C ATOM 1332 CZ PHE A 82 -6.342 -4.187 -2.713 1.00 0.00 C ATOM 0 H PHE A 82 -0.060 -4.358 -5.496 1.00 0.00 H new ATOM 0 HA PHE A 82 -1.886 -6.229 -4.057 1.00 0.00 H new ATOM 0 HB2 PHE A 82 -1.611 -4.428 -2.511 1.00 0.00 H new ATOM 0 HB3 PHE A 82 -1.822 -3.229 -3.772 1.00 0.00 H new ATOM 0 HD1 PHE A 82 -3.613 -6.076 -2.176 1.00 0.00 H new ATOM 0 HD2 PHE A 82 -3.961 -2.432 -4.355 1.00 0.00 H new ATOM 0 HE1 PHE A 82 -6.053 -6.045 -1.658 1.00 0.00 H new ATOM 0 HE2 PHE A 82 -6.385 -2.324 -3.811 1.00 0.00 H new ATOM 0 HZ PHE A 82 -7.402 -4.161 -2.507 1.00 0.00 H new ATOM 1342 N GLY A 83 -3.188 -6.159 -6.178 1.00 0.00 N ATOM 1343 CA GLY A 83 -3.906 -6.203 -7.404 1.00 0.00 C ATOM 1344 C GLY A 83 -4.942 -5.121 -7.555 1.00 0.00 C ATOM 1345 O GLY A 83 -5.063 -4.674 -8.707 1.00 0.00 O ATOM 0 H GLY A 83 -3.337 -6.976 -5.586 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -3.198 -6.129 -8.229 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -4.396 -7.173 -7.490 1.00 0.00 H new ATOM 1349 N GLY A 84 -5.685 -4.856 -6.487 1.00 0.00 N ATOM 1350 CA GLY A 84 -6.759 -3.824 -6.657 1.00 0.00 C ATOM 1351 C GLY A 84 -8.095 -4.288 -6.032 1.00 0.00 C ATOM 1352 O GLY A 84 -8.331 -5.491 -5.874 1.00 0.00 O ATOM 0 H GLY A 84 -5.598 -5.283 -5.565 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -6.444 -2.890 -6.192 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -6.904 -3.620 -7.718 1.00 0.00 H new ATOM 1356 N LEU A 85 -8.940 -3.330 -5.842 1.00 0.00 N ATOM 1357 CA LEU A 85 -10.295 -3.468 -5.268 1.00 0.00 C ATOM 1358 C LEU A 85 -11.239 -2.963 -6.395 1.00 0.00 C ATOM 1359 O LEU A 85 -11.352 -1.769 -6.570 1.00 0.00 O ATOM 1360 CB LEU A 85 -10.350 -2.636 -3.989 1.00 0.00 C ATOM 1361 CG LEU A 85 -10.102 -3.257 -2.634 1.00 0.00 C ATOM 1362 CD1 LEU A 85 -10.005 -2.208 -1.567 1.00 0.00 C ATOM 1363 CD2 LEU A 85 -11.260 -4.147 -2.243 1.00 0.00 C ATOM 0 H LEU A 85 -8.720 -2.365 -6.087 1.00 0.00 H new ATOM 0 HA LEU A 85 -10.582 -4.479 -4.979 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -9.627 -1.828 -4.105 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -11.338 -2.177 -3.951 1.00 0.00 H new ATOM 0 HG LEU A 85 -9.171 -3.818 -2.713 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -9.826 -2.685 -0.603 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -9.181 -1.532 -1.795 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -10.937 -1.644 -1.526 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -11.067 -4.587 -1.265 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -12.175 -3.556 -2.201 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -11.375 -4.940 -2.981 1.00 0.00 H new ATOM 1375 N LYS A 86 -11.748 -3.925 -7.114 1.00 0.00 N ATOM 1376 CA LYS A 86 -12.584 -3.611 -8.280 1.00 0.00 C ATOM 1377 C LYS A 86 -13.936 -3.090 -7.976 1.00 0.00 C ATOM 1378 O LYS A 86 -14.344 -2.329 -8.873 1.00 0.00 O ATOM 1379 CB LYS A 86 -12.764 -4.822 -9.211 1.00 0.00 C ATOM 1380 CG LYS A 86 -11.448 -5.529 -9.460 1.00 0.00 C ATOM 1381 CD LYS A 86 -10.311 -4.508 -9.651 1.00 0.00 C ATOM 1382 CE LYS A 86 -8.891 -4.995 -9.821 1.00 0.00 C ATOM 1383 NZ LYS A 86 -8.090 -4.000 -10.623 1.00 0.00 N ATOM 0 H LYS A 86 -11.613 -4.920 -6.933 1.00 0.00 H new ATOM 0 HA LYS A 86 -12.018 -2.814 -8.763 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -13.476 -5.520 -8.769 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -13.187 -4.493 -10.160 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -11.217 -6.185 -8.621 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -11.530 -6.160 -10.345 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -10.556 -3.907 -10.526 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -10.325 -3.839 -8.791 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -8.430 -5.141 -8.844 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -8.889 -5.963 -10.322 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -7.116 -4.347 -10.733 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -8.523 -3.881 -11.561 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -8.078 -3.085 -10.129 1.00 0.00 H new ATOM 1397 N LYS A 87 -14.547 -3.408 -6.894 1.00 0.00 N ATOM 1398 CA LYS A 87 -15.912 -2.910 -6.613 1.00 0.00 C ATOM 1399 C LYS A 87 -15.822 -1.583 -5.941 1.00 0.00 C ATOM 1400 O LYS A 87 -15.113 -1.367 -4.958 1.00 0.00 O ATOM 1401 CB LYS A 87 -16.566 -3.932 -5.665 1.00 0.00 C ATOM 1402 CG LYS A 87 -16.780 -5.238 -6.459 1.00 0.00 C ATOM 1403 CD LYS A 87 -17.356 -6.356 -5.615 1.00 0.00 C ATOM 1404 CE LYS A 87 -17.689 -7.611 -6.387 1.00 0.00 C ATOM 1405 NZ LYS A 87 -16.829 -7.794 -7.574 1.00 0.00 N ATOM 0 H LYS A 87 -14.154 -4.008 -6.168 1.00 0.00 H new ATOM 0 HA LYS A 87 -16.494 -2.796 -7.527 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -15.930 -4.111 -4.798 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -17.516 -3.552 -5.290 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -17.448 -5.042 -7.297 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -15.828 -5.561 -6.880 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -16.643 -6.606 -4.829 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -18.260 -5.996 -5.124 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -17.584 -8.475 -5.731 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -18.732 -7.574 -6.701 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -16.943 -8.761 -7.939 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -17.103 -7.112 -8.309 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -15.835 -7.638 -7.310 1.00 0.00 H new ATOM 1419 N GLU A 88 -16.546 -0.645 -6.563 1.00 0.00 N ATOM 1420 CA GLU A 88 -16.660 0.674 -6.014 1.00 0.00 C ATOM 1421 C GLU A 88 -17.203 0.630 -4.554 1.00 0.00 C ATOM 1422 O GLU A 88 -16.828 1.437 -3.727 1.00 0.00 O ATOM 1423 CB GLU A 88 -17.556 1.594 -6.837 1.00 0.00 C ATOM 1424 CG GLU A 88 -17.750 3.045 -6.472 1.00 0.00 C ATOM 1425 CD GLU A 88 -18.839 3.613 -7.383 1.00 0.00 C ATOM 1426 OE1 GLU A 88 -19.270 3.088 -8.355 1.00 0.00 O ATOM 1427 OE2 GLU A 88 -19.372 4.725 -6.891 1.00 0.00 O ATOM 0 H GLU A 88 -17.050 -0.791 -7.438 1.00 0.00 H new ATOM 0 HA GLU A 88 -15.649 1.082 -6.031 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -17.177 1.573 -7.859 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -18.546 1.138 -6.855 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -18.039 3.141 -5.425 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -16.819 3.599 -6.598 1.00 0.00 H new ATOM 1434 N LYS A 89 -18.099 -0.260 -4.275 1.00 0.00 N ATOM 1435 CA LYS A 89 -18.690 -0.277 -2.930 1.00 0.00 C ATOM 1436 C LYS A 89 -17.654 -0.605 -1.850 1.00 0.00 C ATOM 1437 O LYS A 89 -17.702 -0.040 -0.781 1.00 0.00 O ATOM 1438 CB LYS A 89 -19.896 -1.116 -2.732 1.00 0.00 C ATOM 1439 CG LYS A 89 -19.774 -2.576 -3.117 1.00 0.00 C ATOM 1440 CD LYS A 89 -20.512 -3.432 -2.102 1.00 0.00 C ATOM 1441 CE LYS A 89 -21.437 -4.393 -2.829 1.00 0.00 C ATOM 1442 NZ LYS A 89 -22.294 -5.065 -1.854 1.00 0.00 N ATOM 0 H LYS A 89 -18.444 -0.972 -4.919 1.00 0.00 H new ATOM 0 HA LYS A 89 -19.044 0.749 -2.827 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -20.180 -1.063 -1.681 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -20.714 -0.679 -3.305 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -20.188 -2.736 -4.113 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -18.724 -2.866 -3.158 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -19.800 -3.987 -1.492 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -21.086 -2.799 -1.425 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -22.045 -3.853 -3.554 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -20.854 -5.127 -3.386 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -22.930 -5.724 -2.347 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -21.704 -5.592 -1.178 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -22.859 -4.357 -1.342 1.00 0.00 H new ATOM 1456 N ASP A 90 -16.779 -1.481 -2.215 1.00 0.00 N ATOM 1457 CA ASP A 90 -15.596 -1.900 -1.336 1.00 0.00 C ATOM 1458 C ASP A 90 -14.641 -0.764 -1.084 1.00 0.00 C ATOM 1459 O ASP A 90 -14.215 -0.469 0.024 1.00 0.00 O ATOM 1460 CB ASP A 90 -14.909 -3.021 -2.121 1.00 0.00 C ATOM 1461 CG ASP A 90 -15.662 -4.288 -1.975 1.00 0.00 C ATOM 1462 OD1 ASP A 90 -16.575 -4.336 -1.045 1.00 0.00 O ATOM 1463 OD2 ASP A 90 -15.394 -5.221 -2.710 1.00 0.00 O ATOM 0 H ASP A 90 -16.810 -1.959 -3.115 1.00 0.00 H new ATOM 0 HA ASP A 90 -15.930 -2.218 -0.348 1.00 0.00 H new ATOM 0 HB2 ASP A 90 -14.843 -2.749 -3.174 1.00 0.00 H new ATOM 0 HB3 ASP A 90 -13.889 -3.153 -1.761 1.00 0.00 H new ATOM 1468 N ARG A 91 -14.264 -0.110 -2.205 1.00 0.00 N ATOM 1469 CA ARG A 91 -13.464 1.093 -2.129 1.00 0.00 C ATOM 1470 C ARG A 91 -14.153 2.182 -1.274 1.00 0.00 C ATOM 1471 O ARG A 91 -13.399 2.770 -0.462 1.00 0.00 O ATOM 1472 CB ARG A 91 -13.170 1.585 -3.542 1.00 0.00 C ATOM 1473 CG ARG A 91 -12.425 0.613 -4.419 1.00 0.00 C ATOM 1474 CD ARG A 91 -11.742 1.256 -5.575 1.00 0.00 C ATOM 1475 NE ARG A 91 -12.641 2.055 -6.447 1.00 0.00 N ATOM 1476 CZ ARG A 91 -13.320 1.566 -7.462 1.00 0.00 C ATOM 1477 NH1 ARG A 91 -13.328 0.297 -7.801 1.00 0.00 N ATOM 1478 NH2 ARG A 91 -14.090 2.352 -8.167 1.00 0.00 N ATOM 0 H ARG A 91 -14.506 -0.404 -3.151 1.00 0.00 H new ATOM 0 HA ARG A 91 -12.522 0.865 -1.631 1.00 0.00 H new ATOM 0 HB2 ARG A 91 -14.114 1.836 -4.026 1.00 0.00 H new ATOM 0 HB3 ARG A 91 -12.591 2.506 -3.475 1.00 0.00 H new ATOM 0 HG2 ARG A 91 -11.684 0.087 -3.817 1.00 0.00 H new ATOM 0 HG3 ARG A 91 -13.123 -0.137 -4.791 1.00 0.00 H new ATOM 0 HD2 ARG A 91 -10.949 1.903 -5.200 1.00 0.00 H new ATOM 0 HD3 ARG A 91 -11.264 0.482 -6.176 1.00 0.00 H new ATOM 0 HE ARG A 91 -12.738 3.050 -6.245 1.00 0.00 H new ATOM 0 HH11 ARG A 91 -12.784 -0.378 -7.264 1.00 0.00 H new ATOM 0 HH12 ARG A 91 -13.878 -0.014 -8.602 1.00 0.00 H new ATOM 0 HH21 ARG A 91 -14.163 3.341 -7.930 1.00 0.00 H new ATOM 0 HH22 ARG A 91 -14.618 1.976 -8.955 1.00 0.00 H new ATOM 1492 N ASN A 92 -15.462 2.391 -1.454 1.00 0.00 N ATOM 1493 CA ASN A 92 -16.136 3.450 -0.667 1.00 0.00 C ATOM 1494 C ASN A 92 -16.063 3.125 0.801 1.00 0.00 C ATOM 1495 O ASN A 92 -15.722 4.085 1.526 1.00 0.00 O ATOM 1496 CB ASN A 92 -17.574 3.700 -1.138 1.00 0.00 C ATOM 1497 CG ASN A 92 -17.592 4.302 -2.528 1.00 0.00 C ATOM 1498 OD1 ASN A 92 -16.569 4.848 -2.987 1.00 0.00 O ATOM 1499 ND2 ASN A 92 -18.726 4.076 -3.204 1.00 0.00 N ATOM 0 H ASN A 92 -16.058 1.875 -2.101 1.00 0.00 H new ATOM 0 HA ASN A 92 -15.606 4.388 -0.834 1.00 0.00 H new ATOM 0 HB2 ASN A 92 -18.129 2.762 -1.137 1.00 0.00 H new ATOM 0 HB3 ASN A 92 -18.078 4.370 -0.441 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -18.802 4.359 -4.181 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -19.513 3.621 -2.742 1.00 0.00 H new ATOM 1506 N ASP A 93 -16.375 1.880 1.162 1.00 0.00 N ATOM 1507 CA ASP A 93 -16.225 1.438 2.485 1.00 0.00 C ATOM 1508 C ASP A 93 -14.759 1.701 3.006 1.00 0.00 C ATOM 1509 O ASP A 93 -14.591 2.332 4.044 1.00 0.00 O ATOM 1510 CB ASP A 93 -16.627 -0.011 2.667 1.00 0.00 C ATOM 1511 CG ASP A 93 -18.141 -0.231 2.535 1.00 0.00 C ATOM 1512 OD1 ASP A 93 -18.908 0.760 2.629 1.00 0.00 O ATOM 1513 OD2 ASP A 93 -18.502 -1.390 2.187 1.00 0.00 O ATOM 0 H ASP A 93 -16.737 1.174 0.520 1.00 0.00 H new ATOM 0 HA ASP A 93 -16.913 2.025 3.094 1.00 0.00 H new ATOM 0 HB2 ASP A 93 -16.110 -0.622 1.927 1.00 0.00 H new ATOM 0 HB3 ASP A 93 -16.299 -0.353 3.649 1.00 0.00 H new ATOM 1518 N LEU A 94 -13.790 1.207 2.310 1.00 0.00 N ATOM 1519 CA LEU A 94 -12.394 1.332 2.793 1.00 0.00 C ATOM 1520 C LEU A 94 -11.975 2.748 2.932 1.00 0.00 C ATOM 1521 O LEU A 94 -11.433 3.143 3.974 1.00 0.00 O ATOM 1522 CB LEU A 94 -11.467 0.525 1.895 1.00 0.00 C ATOM 1523 CG LEU A 94 -10.011 0.666 2.387 1.00 0.00 C ATOM 1524 CD1 LEU A 94 -9.936 -0.060 3.655 1.00 0.00 C ATOM 1525 CD2 LEU A 94 -9.019 0.146 1.389 1.00 0.00 C ATOM 0 H LEU A 94 -13.901 0.718 1.422 1.00 0.00 H new ATOM 0 HA LEU A 94 -12.333 0.916 3.799 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -11.763 -0.524 1.900 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -11.548 0.874 0.865 1.00 0.00 H new ATOM 0 HG LEU A 94 -9.751 1.716 2.519 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -8.923 0.006 4.052 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -10.634 0.379 4.367 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -10.194 -1.106 3.491 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -8.010 0.268 1.782 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -9.211 -0.911 1.202 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -9.115 0.703 0.457 1.00 0.00 H new ATOM 1537 N ILE A 95 -12.202 3.593 1.979 1.00 0.00 N ATOM 1538 CA ILE A 95 -11.827 5.005 2.022 1.00 0.00 C ATOM 1539 C ILE A 95 -12.545 5.747 3.160 1.00 0.00 C ATOM 1540 O ILE A 95 -12.050 6.693 3.818 1.00 0.00 O ATOM 1541 CB ILE A 95 -12.064 5.657 0.685 1.00 0.00 C ATOM 1542 CG1 ILE A 95 -11.111 4.965 -0.288 1.00 0.00 C ATOM 1543 CG2 ILE A 95 -11.713 7.156 0.751 1.00 0.00 C ATOM 1544 CD1 ILE A 95 -11.293 5.324 -1.741 1.00 0.00 C ATOM 0 H ILE A 95 -12.669 3.329 1.111 1.00 0.00 H new ATOM 0 HA ILE A 95 -10.760 5.066 2.236 1.00 0.00 H new ATOM 0 HB ILE A 95 -13.107 5.567 0.382 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -10.088 5.203 0.002 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -11.230 3.887 -0.181 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -11.889 7.614 -0.222 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -12.337 7.643 1.500 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -10.664 7.272 1.022 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -10.568 4.778 -2.344 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -12.302 5.058 -2.058 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -11.142 6.395 -1.873 1.00 0.00 H new ATOM 1556 N THR A 96 -13.790 5.294 3.397 1.00 0.00 N ATOM 1557 CA THR A 96 -14.593 5.863 4.499 1.00 0.00 C ATOM 1558 C THR A 96 -13.812 5.658 5.820 1.00 0.00 C ATOM 1559 O THR A 96 -13.793 6.537 6.690 1.00 0.00 O ATOM 1560 CB THR A 96 -16.093 5.425 4.511 1.00 0.00 C ATOM 1561 OG1 THR A 96 -16.511 5.872 3.242 1.00 0.00 O ATOM 1562 CG2 THR A 96 -16.755 5.998 5.732 1.00 0.00 C ATOM 0 H THR A 96 -14.252 4.560 2.861 1.00 0.00 H new ATOM 0 HA THR A 96 -14.711 6.935 4.344 1.00 0.00 H new ATOM 0 HB THR A 96 -16.334 4.367 4.614 1.00 0.00 H new ATOM 0 HG1 THR A 96 -16.406 5.148 2.589 1.00 0.00 H new ATOM 0 HG21 THR A 96 -17.803 5.699 5.752 1.00 0.00 H new ATOM 0 HG22 THR A 96 -16.255 5.626 6.626 1.00 0.00 H new ATOM 0 HG23 THR A 96 -16.688 7.086 5.705 1.00 0.00 H new ATOM 1570 N TYR A 97 -13.282 4.474 6.039 1.00 0.00 N ATOM 1571 CA TYR A 97 -12.484 4.020 7.161 1.00 0.00 C ATOM 1572 C TYR A 97 -11.117 4.715 7.161 1.00 0.00 C ATOM 1573 O TYR A 97 -10.717 5.332 8.204 1.00 0.00 O ATOM 1574 CB TYR A 97 -12.199 2.467 7.067 1.00 0.00 C ATOM 1575 CG TYR A 97 -11.256 2.083 8.163 1.00 0.00 C ATOM 1576 CD1 TYR A 97 -11.594 2.138 9.518 1.00 0.00 C ATOM 1577 CD2 TYR A 97 -9.922 1.834 7.829 1.00 0.00 C ATOM 1578 CE1 TYR A 97 -10.656 1.800 10.495 1.00 0.00 C ATOM 1579 CE2 TYR A 97 -8.970 1.584 8.765 1.00 0.00 C ATOM 1580 CZ TYR A 97 -9.317 1.557 10.119 1.00 0.00 C ATOM 1581 OH TYR A 97 -8.325 1.284 11.014 1.00 0.00 O ATOM 0 H TYR A 97 -13.414 3.723 5.361 1.00 0.00 H new ATOM 0 HA TYR A 97 -13.049 4.253 8.064 1.00 0.00 H new ATOM 0 HB2 TYR A 97 -13.130 1.906 7.156 1.00 0.00 H new ATOM 0 HB3 TYR A 97 -11.770 2.220 6.096 1.00 0.00 H new ATOM 0 HD1 TYR A 97 -12.587 2.444 9.811 1.00 0.00 H new ATOM 0 HD2 TYR A 97 -9.637 1.841 6.787 1.00 0.00 H new ATOM 0 HE1 TYR A 97 -10.952 1.725 11.531 1.00 0.00 H new ATOM 0 HE2 TYR A 97 -7.948 1.407 8.464 1.00 0.00 H new ATOM 0 HH TYR A 97 -7.549 0.918 10.541 1.00 0.00 H new ATOM 1591 N LEU A 98 -10.547 4.813 5.967 1.00 0.00 N ATOM 1592 CA LEU A 98 -9.249 5.570 5.954 1.00 0.00 C ATOM 1593 C LEU A 98 -9.419 7.050 6.283 1.00 0.00 C ATOM 1594 O LEU A 98 -8.569 7.544 7.104 1.00 0.00 O ATOM 1595 CB LEU A 98 -8.475 5.333 4.682 1.00 0.00 C ATOM 1596 CG LEU A 98 -7.927 3.935 4.375 1.00 0.00 C ATOM 1597 CD1 LEU A 98 -7.385 3.927 2.957 1.00 0.00 C ATOM 1598 CD2 LEU A 98 -6.836 3.499 5.304 1.00 0.00 C ATOM 0 H LEU A 98 -10.888 4.439 5.082 1.00 0.00 H new ATOM 0 HA LEU A 98 -8.644 5.165 6.765 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -9.119 5.620 3.851 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -7.630 6.021 4.682 1.00 0.00 H new ATOM 0 HG LEU A 98 -8.753 3.236 4.504 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -6.991 2.938 2.724 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -8.186 4.172 2.260 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -6.588 4.665 2.868 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -6.498 2.501 5.025 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -6.001 4.196 5.237 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -7.214 3.482 6.326 1.00 0.00 H new ATOM 1610 N LYS A 99 -10.402 7.695 5.677 1.00 0.00 N ATOM 1611 CA LYS A 99 -10.711 9.113 5.964 1.00 0.00 C ATOM 1612 C LYS A 99 -10.723 9.393 7.448 1.00 0.00 C ATOM 1613 O LYS A 99 -10.270 10.393 8.002 1.00 0.00 O ATOM 1614 CB LYS A 99 -12.137 9.478 5.448 1.00 0.00 C ATOM 1615 CG LYS A 99 -12.772 10.767 6.011 1.00 0.00 C ATOM 1616 CD LYS A 99 -14.235 11.126 5.800 1.00 0.00 C ATOM 1617 CE LYS A 99 -15.162 9.945 5.595 1.00 0.00 C ATOM 1618 NZ LYS A 99 -15.454 9.314 6.919 1.00 0.00 N ATOM 0 H LYS A 99 -11.010 7.269 4.978 1.00 0.00 H new ATOM 0 HA LYS A 99 -9.937 9.698 5.467 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -12.093 9.567 4.363 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -12.803 8.645 5.673 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -12.610 10.748 7.089 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -12.188 11.598 5.616 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -14.582 11.695 6.663 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -14.311 11.783 4.933 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -16.088 10.272 5.122 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -14.702 9.218 4.926 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -15.261 8.293 6.867 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -14.851 9.744 7.649 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -16.454 9.465 7.163 1.00 0.00 H new ATOM 1632 N LYS A 100 -11.373 8.490 8.160 1.00 0.00 N ATOM 1633 CA LYS A 100 -11.487 8.549 9.611 1.00 0.00 C ATOM 1634 C LYS A 100 -10.280 8.176 10.442 1.00 0.00 C ATOM 1635 O LYS A 100 -10.077 8.912 11.427 1.00 0.00 O ATOM 1636 CB LYS A 100 -12.670 7.668 10.075 1.00 0.00 C ATOM 1637 CG LYS A 100 -13.898 8.125 9.272 1.00 0.00 C ATOM 1638 CD LYS A 100 -14.329 9.483 9.922 1.00 0.00 C ATOM 1639 CE LYS A 100 -15.302 9.196 11.068 1.00 0.00 C ATOM 1640 NZ LYS A 100 -15.669 10.439 11.790 1.00 0.00 N ATOM 0 H LYS A 100 -11.843 7.685 7.745 1.00 0.00 H new ATOM 0 HA LYS A 100 -11.626 9.615 9.793 1.00 0.00 H new ATOM 0 HB2 LYS A 100 -12.461 6.613 9.897 1.00 0.00 H new ATOM 0 HB3 LYS A 100 -12.842 7.782 11.145 1.00 0.00 H new ATOM 0 HG2 LYS A 100 -13.654 8.253 8.217 1.00 0.00 H new ATOM 0 HG3 LYS A 100 -14.701 7.390 9.327 1.00 0.00 H new ATOM 0 HD2 LYS A 100 -13.455 10.017 10.294 1.00 0.00 H new ATOM 0 HD3 LYS A 100 -14.801 10.124 9.178 1.00 0.00 H new ATOM 0 HE2 LYS A 100 -16.202 8.723 10.674 1.00 0.00 H new ATOM 0 HE3 LYS A 100 -14.849 8.489 11.764 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 -16.329 10.211 12.560 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 -14.812 10.876 12.186 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 -16.123 11.103 11.130 1.00 0.00 H new ATOM 1654 N ALA A 101 -9.634 7.077 10.091 1.00 0.00 N ATOM 1655 CA ALA A 101 -8.534 6.577 10.939 1.00 0.00 C ATOM 1656 C ALA A 101 -7.217 7.243 10.695 1.00 0.00 C ATOM 1657 O ALA A 101 -6.385 7.262 11.626 1.00 0.00 O ATOM 1658 CB ALA A 101 -8.264 5.082 10.766 1.00 0.00 C ATOM 0 H ALA A 101 -9.832 6.522 9.258 1.00 0.00 H new ATOM 0 HA ALA A 101 -8.901 6.805 11.940 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -7.444 4.782 11.419 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -9.160 4.518 11.027 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -7.996 4.878 9.729 1.00 0.00 H new ATOM 1664 N THR A 102 -7.119 7.804 9.557 1.00 0.00 N ATOM 1665 CA THR A 102 -5.842 8.562 9.223 1.00 0.00 C ATOM 1666 C THR A 102 -5.799 10.021 9.602 1.00 0.00 C ATOM 1667 O THR A 102 -4.851 10.759 9.385 1.00 0.00 O ATOM 1668 CB THR A 102 -5.594 8.524 7.720 1.00 0.00 C ATOM 1669 OG1 THR A 102 -4.382 9.219 7.418 1.00 0.00 O ATOM 1670 CG2 THR A 102 -6.757 9.196 6.996 1.00 0.00 C ATOM 0 H THR A 102 -7.833 7.794 8.829 1.00 0.00 H new ATOM 0 HA THR A 102 -5.091 8.046 9.821 1.00 0.00 H new ATOM 0 HB THR A 102 -5.510 7.488 7.393 1.00 0.00 H new ATOM 0 HG1 THR A 102 -3.686 8.573 7.176 1.00 0.00 H new ATOM 0 HG21 THR A 102 -6.580 9.169 5.921 1.00 0.00 H new ATOM 0 HG22 THR A 102 -7.682 8.667 7.225 1.00 0.00 H new ATOM 0 HG23 THR A 102 -6.840 10.232 7.324 1.00 0.00 H new ATOM 1678 N GLU A 103 -6.799 10.533 10.267 1.00 0.00 N ATOM 1679 CA GLU A 103 -6.771 11.961 10.639 1.00 0.00 C ATOM 1680 C GLU A 103 -6.096 12.119 12.002 1.00 0.00 C ATOM 1681 O GLU A 103 -5.570 13.250 12.188 1.00 0.00 O ATOM 1682 CB GLU A 103 -8.206 12.405 10.815 1.00 0.00 C ATOM 1683 CG GLU A 103 -8.561 13.892 10.867 1.00 0.00 C ATOM 1684 CD GLU A 103 -7.969 14.563 9.662 1.00 0.00 C ATOM 1685 OE1 GLU A 103 -8.095 13.799 8.597 1.00 0.00 O ATOM 1686 OE2 GLU A 103 -7.332 15.589 9.637 1.00 0.00 O ATOM 1687 OXT GLU A 103 -6.542 11.288 12.828 1.00 0.00 O ATOM 0 H GLU A 103 -7.629 10.019 10.565 1.00 0.00 H new ATOM 0 HA GLU A 103 -6.241 12.535 9.879 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -8.780 11.966 9.999 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -8.570 11.955 11.739 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -9.643 14.023 10.881 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -8.173 14.343 11.781 1.00 0.00 H new TER 1694 GLU A 103 ATOM 1695 N LYS B 6 13.294 -37.742 -2.313 1.00 0.00 N ATOM 1696 CA LYS B 6 12.901 -36.734 -1.315 1.00 0.00 C ATOM 1697 C LYS B 6 14.096 -36.334 -0.463 1.00 0.00 C ATOM 1698 O LYS B 6 15.075 -37.090 -0.357 1.00 0.00 O ATOM 1699 CB LYS B 6 11.759 -37.264 -0.455 1.00 0.00 C ATOM 1700 CG LYS B 6 11.697 -38.784 -0.367 1.00 0.00 C ATOM 1701 CD LYS B 6 10.759 -39.256 0.734 1.00 0.00 C ATOM 1702 CE LYS B 6 10.847 -40.755 0.940 1.00 0.00 C ATOM 1703 NZ LYS B 6 10.732 -41.133 2.384 1.00 0.00 N ATOM 0 HA LYS B 6 12.549 -35.842 -1.832 1.00 0.00 H new ATOM 0 HB2 LYS B 6 11.858 -36.857 0.551 1.00 0.00 H new ATOM 0 HB3 LYS B 6 10.815 -36.896 -0.857 1.00 0.00 H new ATOM 0 HG2 LYS B 6 11.366 -39.189 -1.323 1.00 0.00 H new ATOM 0 HG3 LYS B 6 12.697 -39.177 -0.184 1.00 0.00 H new ATOM 0 HD2 LYS B 6 11.005 -38.746 1.665 1.00 0.00 H new ATOM 0 HD3 LYS B 6 9.734 -38.983 0.481 1.00 0.00 H new ATOM 0 HE2 LYS B 6 10.056 -41.245 0.373 1.00 0.00 H new ATOM 0 HE3 LYS B 6 11.795 -41.120 0.545 1.00 0.00 H new ATOM 0 HZ1 LYS B 6 10.797 -42.167 2.479 1.00 0.00 H new ATOM 0 HZ2 LYS B 6 11.502 -40.687 2.922 1.00 0.00 H new ATOM 0 HZ3 LYS B 6 9.817 -40.809 2.756 1.00 0.00 H new ATOM 1717 N ILE B 7 14.097 -35.105 0.049 1.00 0.00 N ATOM 1718 CA ILE B 7 15.207 -34.618 0.857 1.00 0.00 C ATOM 1719 C ILE B 7 14.708 -34.000 2.171 1.00 0.00 C ATOM 1720 O ILE B 7 13.605 -33.470 2.246 1.00 0.00 O ATOM 1721 CB ILE B 7 16.064 -33.568 0.146 1.00 0.00 C ATOM 1722 CG1 ILE B 7 15.244 -32.303 -0.128 1.00 0.00 C ATOM 1723 CG2 ILE B 7 16.741 -34.074 -1.101 1.00 0.00 C ATOM 1724 CD1 ILE B 7 16.092 -31.056 -0.226 1.00 0.00 C ATOM 0 H ILE B 7 13.342 -34.431 -0.082 1.00 0.00 H new ATOM 0 HA ILE B 7 15.822 -35.498 1.048 1.00 0.00 H new ATOM 0 HB ILE B 7 16.877 -33.321 0.829 1.00 0.00 H new ATOM 0 HG12 ILE B 7 14.689 -32.431 -1.057 1.00 0.00 H new ATOM 0 HG13 ILE B 7 14.510 -32.174 0.667 1.00 0.00 H new ATOM 0 HG21 ILE B 7 17.329 -33.272 -1.547 1.00 0.00 H new ATOM 0 HG22 ILE B 7 17.397 -34.906 -0.847 1.00 0.00 H new ATOM 0 HG23 ILE B 7 15.987 -34.410 -1.813 1.00 0.00 H new ATOM 0 HD11 ILE B 7 15.452 -30.195 -0.421 1.00 0.00 H new ATOM 0 HD12 ILE B 7 16.627 -30.905 0.712 1.00 0.00 H new ATOM 0 HD13 ILE B 7 16.809 -31.167 -1.039 1.00 0.00 H new ATOM 1736 N THR B 8 15.585 -34.018 3.172 1.00 0.00 N ATOM 1737 CA THR B 8 15.282 -33.453 4.472 1.00 0.00 C ATOM 1738 C THR B 8 15.630 -31.961 4.517 1.00 0.00 C ATOM 1739 O THR B 8 16.669 -31.537 4.007 1.00 0.00 O ATOM 1740 CB THR B 8 16.033 -34.157 5.613 1.00 0.00 C ATOM 1741 OG1 THR B 8 15.859 -35.578 5.525 1.00 0.00 O ATOM 1742 CG2 THR B 8 15.505 -33.695 6.969 1.00 0.00 C ATOM 0 H THR B 8 16.518 -34.423 3.100 1.00 0.00 H new ATOM 0 HA THR B 8 14.211 -33.598 4.617 1.00 0.00 H new ATOM 0 HB THR B 8 17.089 -33.903 5.520 1.00 0.00 H new ATOM 0 HG1 THR B 8 16.344 -36.013 6.257 1.00 0.00 H new ATOM 0 HG21 THR B 8 16.049 -34.205 7.764 1.00 0.00 H new ATOM 0 HG22 THR B 8 15.645 -32.618 7.066 1.00 0.00 H new ATOM 0 HG23 THR B 8 14.444 -33.932 7.046 1.00 0.00 H new ATOM 1750 N VAL B 9 14.714 -31.175 5.072 1.00 0.00 N ATOM 1751 CA VAL B 9 14.973 -29.732 5.251 1.00 0.00 C ATOM 1752 C VAL B 9 14.652 -29.366 6.708 1.00 0.00 C ATOM 1753 O VAL B 9 13.601 -29.763 7.212 1.00 0.00 O ATOM 1754 CB VAL B 9 14.114 -28.870 4.326 1.00 0.00 C ATOM 1755 CG1 VAL B 9 14.344 -27.382 4.639 1.00 0.00 C ATOM 1756 CG2 VAL B 9 14.414 -29.120 2.859 1.00 0.00 C ATOM 0 H VAL B 9 13.803 -31.493 5.402 1.00 0.00 H new ATOM 0 HA VAL B 9 16.017 -29.539 5.006 1.00 0.00 H new ATOM 0 HB VAL B 9 13.074 -29.143 4.506 1.00 0.00 H new ATOM 0 HG11 VAL B 9 13.730 -26.772 3.977 1.00 0.00 H new ATOM 0 HG12 VAL B 9 14.071 -27.182 5.675 1.00 0.00 H new ATOM 0 HG13 VAL B 9 15.395 -27.136 4.487 1.00 0.00 H new ATOM 0 HG21 VAL B 9 13.778 -28.484 2.244 1.00 0.00 H new ATOM 0 HG22 VAL B 9 15.460 -28.890 2.657 1.00 0.00 H new ATOM 0 HG23 VAL B 9 14.220 -30.166 2.621 1.00 0.00 H new ATOM 1766 N HIS B 10 15.552 -28.633 7.348 1.00 0.00 N ATOM 1767 CA HIS B 10 15.311 -28.193 8.733 1.00 0.00 C ATOM 1768 C HIS B 10 14.998 -26.685 8.737 1.00 0.00 C ATOM 1769 O HIS B 10 15.707 -25.932 8.081 1.00 0.00 O ATOM 1770 CB HIS B 10 16.587 -28.402 9.555 1.00 0.00 C ATOM 1771 CG HIS B 10 17.137 -29.790 9.507 1.00 0.00 C ATOM 1772 ND1 HIS B 10 16.563 -30.849 10.179 1.00 0.00 N ATOM 1773 CD2 HIS B 10 18.250 -30.281 8.899 1.00 0.00 C ATOM 1774 CE1 HIS B 10 17.285 -31.942 9.958 1.00 0.00 C ATOM 1775 NE2 HIS B 10 18.307 -31.624 9.201 1.00 0.00 N ATOM 0 H HIS B 10 16.441 -28.331 6.949 1.00 0.00 H new ATOM 0 HA HIS B 10 14.481 -28.762 9.153 1.00 0.00 H new ATOM 0 HB2 HIS B 10 17.350 -27.710 9.199 1.00 0.00 H new ATOM 0 HB3 HIS B 10 16.381 -28.142 10.593 1.00 0.00 H new ATOM 0 HD2 HIS B 10 18.953 -29.726 8.296 1.00 0.00 H new ATOM 0 HE1 HIS B 10 17.066 -32.929 10.339 1.00 0.00 H new ATOM 0 HE2 HIS B 10 19.031 -32.270 8.885 1.00 0.00 H new ATOM 1783 N PHE B 11 13.979 -26.289 9.468 1.00 0.00 N ATOM 1784 CA PHE B 11 13.604 -24.888 9.580 1.00 0.00 C ATOM 1785 C PHE B 11 13.771 -24.451 11.048 1.00 0.00 C ATOM 1786 O PHE B 11 13.188 -25.087 11.929 1.00 0.00 O ATOM 1787 CB PHE B 11 12.139 -24.660 9.207 1.00 0.00 C ATOM 1788 CG PHE B 11 11.743 -24.899 7.800 1.00 0.00 C ATOM 1789 CD1 PHE B 11 11.653 -26.188 7.283 1.00 0.00 C ATOM 1790 CD2 PHE B 11 11.394 -23.842 6.965 1.00 0.00 C ATOM 1791 CE1 PHE B 11 11.261 -26.408 5.990 1.00 0.00 C ATOM 1792 CE2 PHE B 11 10.996 -24.060 5.665 1.00 0.00 C ATOM 1793 CZ PHE B 11 10.912 -25.347 5.172 1.00 0.00 C ATOM 0 H PHE B 11 13.386 -26.924 10.002 1.00 0.00 H new ATOM 0 HA PHE B 11 14.240 -24.319 8.902 1.00 0.00 H new ATOM 0 HB2 PHE B 11 11.527 -25.301 9.841 1.00 0.00 H new ATOM 0 HB3 PHE B 11 11.885 -23.630 9.457 1.00 0.00 H new ATOM 0 HD1 PHE B 11 11.897 -27.030 7.914 1.00 0.00 H new ATOM 0 HD2 PHE B 11 11.436 -22.831 7.344 1.00 0.00 H new ATOM 0 HE1 PHE B 11 11.224 -27.416 5.605 1.00 0.00 H new ATOM 0 HE2 PHE B 11 10.749 -23.222 5.030 1.00 0.00 H new ATOM 0 HZ PHE B 11 10.578 -25.524 4.160 1.00 0.00 H new ATOM 1803 N ILE B 12 14.598 -23.445 11.276 1.00 0.00 N ATOM 1804 CA ILE B 12 14.671 -22.841 12.602 1.00 0.00 C ATOM 1805 C ILE B 12 13.610 -21.725 12.663 1.00 0.00 C ATOM 1806 O ILE B 12 13.739 -20.707 12.004 1.00 0.00 O ATOM 1807 CB ILE B 12 16.032 -22.271 12.967 1.00 0.00 C ATOM 1808 CG1 ILE B 12 17.130 -23.330 12.845 1.00 0.00 C ATOM 1809 CG2 ILE B 12 16.012 -21.741 14.421 1.00 0.00 C ATOM 1810 CD1 ILE B 12 18.528 -22.782 12.996 1.00 0.00 C ATOM 0 H ILE B 12 15.218 -23.034 10.578 1.00 0.00 H new ATOM 0 HA ILE B 12 14.490 -23.633 13.329 1.00 0.00 H new ATOM 0 HB ILE B 12 16.246 -21.459 12.272 1.00 0.00 H new ATOM 0 HG12 ILE B 12 16.967 -24.097 13.602 1.00 0.00 H new ATOM 0 HG13 ILE B 12 17.044 -23.818 11.874 1.00 0.00 H new ATOM 0 HG21 ILE B 12 16.991 -21.335 14.674 1.00 0.00 H new ATOM 0 HG22 ILE B 12 15.259 -20.958 14.512 1.00 0.00 H new ATOM 0 HG23 ILE B 12 15.771 -22.557 15.102 1.00 0.00 H new ATOM 0 HD11 ILE B 12 19.249 -23.593 12.897 1.00 0.00 H new ATOM 0 HD12 ILE B 12 18.712 -22.036 12.222 1.00 0.00 H new ATOM 0 HD13 ILE B 12 18.634 -22.320 13.978 1.00 0.00 H new ATOM 1822 N ASN B 13 12.525 -22.027 13.367 1.00 0.00 N ATOM 1823 CA ASN B 13 11.395 -21.067 13.411 1.00 0.00 C ATOM 1824 C ASN B 13 11.768 -19.884 14.262 1.00 0.00 C ATOM 1825 O ASN B 13 12.799 -19.933 14.960 1.00 0.00 O ATOM 1826 CB ASN B 13 10.163 -21.801 13.924 1.00 0.00 C ATOM 1827 CG ASN B 13 8.869 -21.090 13.625 1.00 0.00 C ATOM 1828 OD1 ASN B 13 8.872 -19.998 13.042 1.00 0.00 O ATOM 1829 ND2 ASN B 13 7.756 -21.690 14.039 1.00 0.00 N ATOM 0 H ASN B 13 12.391 -22.887 13.899 1.00 0.00 H new ATOM 0 HA ASN B 13 11.167 -20.678 12.419 1.00 0.00 H new ATOM 0 HB2 ASN B 13 10.132 -22.796 13.480 1.00 0.00 H new ATOM 0 HB3 ASN B 13 10.253 -21.936 15.002 1.00 0.00 H new ATOM 0 HD21 ASN B 13 6.850 -21.249 13.880 1.00 0.00 H new ATOM 0 HD22 ASN B 13 7.809 -22.591 14.515 1.00 0.00 H new ATOM 1836 N ARG B 14 10.989 -18.812 14.264 1.00 0.00 N ATOM 1837 CA ARG B 14 11.339 -17.620 15.036 1.00 0.00 C ATOM 1838 C ARG B 14 11.318 -17.867 16.537 1.00 0.00 C ATOM 1839 O ARG B 14 12.035 -17.181 17.289 1.00 0.00 O ATOM 1840 CB ARG B 14 10.528 -16.409 14.677 1.00 0.00 C ATOM 1841 CG ARG B 14 9.449 -16.547 13.644 1.00 0.00 C ATOM 1842 CD ARG B 14 8.634 -15.248 13.516 1.00 0.00 C ATOM 1843 NE ARG B 14 8.552 -14.823 12.130 1.00 0.00 N ATOM 1844 CZ ARG B 14 7.716 -15.300 11.214 1.00 0.00 C ATOM 1845 NH1 ARG B 14 6.830 -16.235 11.512 1.00 0.00 N ATOM 1846 NH2 ARG B 14 7.747 -14.804 9.982 1.00 0.00 N ATOM 0 H ARG B 14 10.114 -18.739 13.744 1.00 0.00 H new ATOM 0 HA ARG B 14 12.368 -17.399 14.751 1.00 0.00 H new ATOM 0 HB2 ARG B 14 10.065 -16.038 15.591 1.00 0.00 H new ATOM 0 HB3 ARG B 14 11.218 -15.638 14.334 1.00 0.00 H new ATOM 0 HG2 ARG B 14 9.894 -16.797 12.681 1.00 0.00 H new ATOM 0 HG3 ARG B 14 8.787 -17.370 13.913 1.00 0.00 H new ATOM 0 HD2 ARG B 14 7.631 -15.403 13.913 1.00 0.00 H new ATOM 0 HD3 ARG B 14 9.096 -14.463 14.115 1.00 0.00 H new ATOM 0 HE ARG B 14 9.196 -14.090 11.832 1.00 0.00 H new ATOM 0 HH11 ARG B 14 6.778 -16.605 12.461 1.00 0.00 H new ATOM 0 HH12 ARG B 14 6.198 -16.587 10.793 1.00 0.00 H new ATOM 0 HH21 ARG B 14 8.408 -14.064 9.747 1.00 0.00 H new ATOM 0 HH22 ARG B 14 7.109 -15.163 9.271 1.00 0.00 H new ATOM 1860 N ASP B 15 10.542 -18.845 16.987 1.00 0.00 N ATOM 1861 CA ASP B 15 10.487 -19.226 18.388 1.00 0.00 C ATOM 1862 C ASP B 15 11.726 -19.993 18.823 1.00 0.00 C ATOM 1863 O ASP B 15 11.983 -20.139 20.023 1.00 0.00 O ATOM 1864 CB ASP B 15 9.221 -20.011 18.706 1.00 0.00 C ATOM 1865 CG ASP B 15 8.937 -21.162 17.777 1.00 0.00 C ATOM 1866 OD1 ASP B 15 9.801 -21.516 16.945 1.00 0.00 O ATOM 1867 OD2 ASP B 15 7.816 -21.742 17.854 1.00 0.00 O ATOM 0 H ASP B 15 9.931 -19.397 16.385 1.00 0.00 H new ATOM 0 HA ASP B 15 10.461 -18.300 18.962 1.00 0.00 H new ATOM 0 HB2 ASP B 15 9.295 -20.394 19.724 1.00 0.00 H new ATOM 0 HB3 ASP B 15 8.372 -19.328 18.684 1.00 0.00 H new ATOM 1872 N GLY B 16 12.521 -20.474 17.870 1.00 0.00 N ATOM 1873 CA GLY B 16 13.752 -21.180 18.192 1.00 0.00 C ATOM 1874 C GLY B 16 13.605 -22.681 17.997 1.00 0.00 C ATOM 1875 O GLY B 16 14.594 -23.409 18.049 1.00 0.00 O ATOM 0 H GLY B 16 12.333 -20.386 16.871 1.00 0.00 H new ATOM 0 HA2 GLY B 16 14.560 -20.808 17.562 1.00 0.00 H new ATOM 0 HA3 GLY B 16 14.031 -20.973 19.225 1.00 0.00 H new ATOM 1879 N GLU B 17 12.374 -23.139 17.766 1.00 0.00 N ATOM 1880 CA GLU B 17 12.144 -24.571 17.559 1.00 0.00 C ATOM 1881 C GLU B 17 12.586 -24.981 16.152 1.00 0.00 C ATOM 1882 O GLU B 17 12.366 -24.244 15.187 1.00 0.00 O ATOM 1883 CB GLU B 17 10.686 -24.941 17.768 1.00 0.00 C ATOM 1884 CG GLU B 17 10.002 -24.293 18.951 1.00 0.00 C ATOM 1885 CD GLU B 17 10.480 -24.838 20.280 1.00 0.00 C ATOM 1886 OE1 GLU B 17 11.621 -24.508 20.683 1.00 0.00 O ATOM 1887 OE2 GLU B 17 9.726 -25.596 20.923 1.00 0.00 O ATOM 0 H GLU B 17 11.538 -22.556 17.718 1.00 0.00 H new ATOM 0 HA GLU B 17 12.738 -25.109 18.298 1.00 0.00 H new ATOM 0 HB2 GLU B 17 10.132 -24.681 16.866 1.00 0.00 H new ATOM 0 HB3 GLU B 17 10.619 -26.023 17.882 1.00 0.00 H new ATOM 0 HG2 GLU B 17 10.177 -23.218 18.921 1.00 0.00 H new ATOM 0 HG3 GLU B 17 8.926 -24.443 18.869 1.00 0.00 H new ATOM 1894 N THR B 18 13.205 -26.157 16.049 1.00 0.00 N ATOM 1895 CA THR B 18 13.619 -26.673 14.765 1.00 0.00 C ATOM 1896 C THR B 18 12.560 -27.602 14.185 1.00 0.00 C ATOM 1897 O THR B 18 12.108 -28.546 14.834 1.00 0.00 O ATOM 1898 CB THR B 18 14.976 -27.378 14.801 1.00 0.00 C ATOM 1899 OG1 THR B 18 16.005 -26.397 15.035 1.00 0.00 O ATOM 1900 CG2 THR B 18 15.264 -28.060 13.466 1.00 0.00 C ATOM 0 H THR B 18 13.425 -26.760 16.841 1.00 0.00 H new ATOM 0 HA THR B 18 13.734 -25.804 14.117 1.00 0.00 H new ATOM 0 HB THR B 18 14.959 -28.126 15.593 1.00 0.00 H new ATOM 0 HG1 THR B 18 16.879 -26.840 15.062 1.00 0.00 H new ATOM 0 HG21 THR B 18 16.234 -28.556 13.512 1.00 0.00 H new ATOM 0 HG22 THR B 18 14.489 -28.798 13.260 1.00 0.00 H new ATOM 0 HG23 THR B 18 15.275 -27.314 12.671 1.00 0.00 H new ATOM 1908 N LEU B 19 12.075 -27.239 13.008 1.00 0.00 N ATOM 1909 CA LEU B 19 11.065 -28.030 12.310 1.00 0.00 C ATOM 1910 C LEU B 19 11.782 -28.880 11.255 1.00 0.00 C ATOM 1911 O LEU B 19 12.403 -28.314 10.363 1.00 0.00 O ATOM 1912 CB LEU B 19 10.068 -27.109 11.621 1.00 0.00 C ATOM 1913 CG LEU B 19 8.958 -26.452 12.369 1.00 0.00 C ATOM 1914 CD1 LEU B 19 9.064 -26.540 13.879 1.00 0.00 C ATOM 1915 CD2 LEU B 19 8.750 -24.997 11.935 1.00 0.00 C ATOM 0 H LEU B 19 12.365 -26.397 12.511 1.00 0.00 H new ATOM 0 HA LEU B 19 10.527 -28.662 13.017 1.00 0.00 H new ATOM 0 HB2 LEU B 19 10.646 -26.313 11.152 1.00 0.00 H new ATOM 0 HB3 LEU B 19 9.609 -27.686 10.818 1.00 0.00 H new ATOM 0 HG LEU B 19 8.079 -27.036 12.096 1.00 0.00 H new ATOM 0 HD11 LEU B 19 8.212 -26.034 14.334 1.00 0.00 H new ATOM 0 HD12 LEU B 19 9.069 -27.587 14.183 1.00 0.00 H new ATOM 0 HD13 LEU B 19 9.987 -26.063 14.207 1.00 0.00 H new ATOM 0 HD21 LEU B 19 7.931 -24.560 12.507 1.00 0.00 H new ATOM 0 HD22 LEU B 19 9.663 -24.429 12.116 1.00 0.00 H new ATOM 0 HD23 LEU B 19 8.508 -24.965 10.873 1.00 0.00 H new ATOM 1927 N THR B 20 11.747 -30.192 11.437 1.00 0.00 N ATOM 1928 CA THR B 20 12.418 -31.070 10.458 1.00 0.00 C ATOM 1929 C THR B 20 11.356 -31.717 9.581 1.00 0.00 C ATOM 1930 O THR B 20 10.352 -32.213 10.107 1.00 0.00 O ATOM 1931 CB THR B 20 13.284 -32.118 11.149 1.00 0.00 C ATOM 1932 OG1 THR B 20 14.274 -31.450 11.964 1.00 0.00 O ATOM 1933 CG2 THR B 20 14.000 -33.000 10.134 1.00 0.00 C ATOM 0 H THR B 20 11.286 -30.667 12.213 1.00 0.00 H new ATOM 0 HA THR B 20 13.089 -30.476 9.838 1.00 0.00 H new ATOM 0 HB THR B 20 12.637 -32.746 11.761 1.00 0.00 H new ATOM 0 HG1 THR B 20 15.056 -31.231 11.415 1.00 0.00 H new ATOM 0 HG21 THR B 20 14.609 -33.737 10.658 1.00 0.00 H new ATOM 0 HG22 THR B 20 13.264 -33.512 9.514 1.00 0.00 H new ATOM 0 HG23 THR B 20 14.640 -32.383 9.503 1.00 0.00 H new ATOM 1941 N THR B 21 11.488 -31.571 8.268 1.00 0.00 N ATOM 1942 CA THR B 21 10.489 -32.123 7.358 1.00 0.00 C ATOM 1943 C THR B 21 11.112 -32.534 6.037 1.00 0.00 C ATOM 1944 O THR B 21 12.302 -32.319 5.787 1.00 0.00 O ATOM 1945 CB THR B 21 9.324 -31.148 7.112 1.00 0.00 C ATOM 1946 OG1 THR B 21 8.232 -31.838 6.497 1.00 0.00 O ATOM 1947 CG2 THR B 21 9.749 -30.003 6.207 1.00 0.00 C ATOM 0 H THR B 21 12.262 -31.085 7.815 1.00 0.00 H new ATOM 0 HA THR B 21 10.084 -33.010 7.845 1.00 0.00 H new ATOM 0 HB THR B 21 9.019 -30.744 8.077 1.00 0.00 H new ATOM 0 HG1 THR B 21 7.441 -31.778 7.073 1.00 0.00 H new ATOM 0 HG21 THR B 21 8.906 -29.330 6.051 1.00 0.00 H new ATOM 0 HG22 THR B 21 10.568 -29.456 6.673 1.00 0.00 H new ATOM 0 HG23 THR B 21 10.078 -30.401 5.247 1.00 0.00 H new ATOM 1955 N LYS B 22 10.315 -33.174 5.197 1.00 0.00 N ATOM 1956 CA LYS B 22 10.793 -33.653 3.907 1.00 0.00 C ATOM 1957 C LYS B 22 10.000 -33.034 2.769 1.00 0.00 C ATOM 1958 O LYS B 22 8.805 -32.762 2.915 1.00 0.00 O ATOM 1959 CB LYS B 22 10.700 -35.190 3.866 1.00 0.00 C ATOM 1960 CG LYS B 22 11.695 -35.869 4.812 1.00 0.00 C ATOM 1961 CD LYS B 22 12.047 -37.260 4.325 1.00 0.00 C ATOM 1962 CE LYS B 22 12.174 -38.238 5.488 1.00 0.00 C ATOM 1963 NZ LYS B 22 13.101 -39.362 5.129 1.00 0.00 N ATOM 0 H LYS B 22 9.333 -33.375 5.384 1.00 0.00 H new ATOM 0 HA LYS B 22 11.834 -33.354 3.782 1.00 0.00 H new ATOM 0 HB2 LYS B 22 9.688 -35.496 4.130 1.00 0.00 H new ATOM 0 HB3 LYS B 22 10.881 -35.534 2.848 1.00 0.00 H new ATOM 0 HG2 LYS B 22 12.600 -35.266 4.887 1.00 0.00 H new ATOM 0 HG3 LYS B 22 11.268 -35.928 5.813 1.00 0.00 H new ATOM 0 HD2 LYS B 22 11.280 -37.611 3.634 1.00 0.00 H new ATOM 0 HD3 LYS B 22 12.985 -37.227 3.770 1.00 0.00 H new ATOM 0 HE2 LYS B 22 12.548 -37.718 6.370 1.00 0.00 H new ATOM 0 HE3 LYS B 22 11.192 -38.636 5.745 1.00 0.00 H new ATOM 0 HZ1 LYS B 22 13.177 -40.019 5.931 1.00 0.00 H new ATOM 0 HZ2 LYS B 22 12.728 -39.868 4.301 1.00 0.00 H new ATOM 0 HZ3 LYS B 22 14.042 -38.978 4.906 1.00 0.00 H new ATOM 1977 N GLY B 23 10.661 -32.768 1.661 1.00 0.00 N ATOM 1978 CA GLY B 23 10.040 -32.282 0.450 1.00 0.00 C ATOM 1979 C GLY B 23 10.647 -33.023 -0.753 1.00 0.00 C ATOM 1980 O GLY B 23 11.701 -33.639 -0.609 1.00 0.00 O ATOM 0 H GLY B 23 11.671 -32.888 1.578 1.00 0.00 H new ATOM 0 HA2 GLY B 23 8.963 -32.444 0.488 1.00 0.00 H new ATOM 0 HA3 GLY B 23 10.198 -31.208 0.350 1.00 0.00 H new ATOM 1984 N LYS B 24 10.006 -32.930 -1.908 1.00 0.00 N ATOM 1985 CA LYS B 24 10.527 -33.588 -3.103 1.00 0.00 C ATOM 1986 C LYS B 24 11.301 -32.605 -3.967 1.00 0.00 C ATOM 1987 O LYS B 24 10.913 -31.440 -4.082 1.00 0.00 O ATOM 1988 CB LYS B 24 9.410 -34.233 -3.918 1.00 0.00 C ATOM 1989 CG LYS B 24 7.999 -33.868 -3.507 1.00 0.00 C ATOM 1990 CD LYS B 24 7.113 -33.610 -4.720 1.00 0.00 C ATOM 1991 CE LYS B 24 6.860 -34.878 -5.514 1.00 0.00 C ATOM 1992 NZ LYS B 24 5.951 -34.627 -6.675 1.00 0.00 N ATOM 0 H LYS B 24 9.137 -32.414 -2.046 1.00 0.00 H new ATOM 0 HA LYS B 24 11.204 -34.375 -2.771 1.00 0.00 H new ATOM 0 HB2 LYS B 24 9.545 -33.960 -4.965 1.00 0.00 H new ATOM 0 HB3 LYS B 24 9.518 -35.316 -3.854 1.00 0.00 H new ATOM 0 HG2 LYS B 24 7.573 -34.674 -2.909 1.00 0.00 H new ATOM 0 HG3 LYS B 24 8.021 -32.980 -2.876 1.00 0.00 H new ATOM 0 HD2 LYS B 24 6.162 -33.191 -4.392 1.00 0.00 H new ATOM 0 HD3 LYS B 24 7.585 -32.867 -5.363 1.00 0.00 H new ATOM 0 HE2 LYS B 24 7.808 -35.279 -5.873 1.00 0.00 H new ATOM 0 HE3 LYS B 24 6.420 -35.634 -4.863 1.00 0.00 H new ATOM 0 HZ1 LYS B 24 5.800 -35.515 -7.196 1.00 0.00 H new ATOM 0 HZ2 LYS B 24 5.038 -34.268 -6.330 1.00 0.00 H new ATOM 0 HZ3 LYS B 24 6.383 -33.924 -7.308 1.00 0.00 H new ATOM 2006 N ILE B 25 12.382 -33.079 -4.595 1.00 0.00 N ATOM 2007 CA ILE B 25 13.142 -32.161 -5.469 1.00 0.00 C ATOM 2008 C ILE B 25 12.176 -31.541 -6.467 1.00 0.00 C ATOM 2009 O ILE B 25 11.200 -32.176 -6.889 1.00 0.00 O ATOM 2010 CB ILE B 25 14.377 -32.762 -6.071 1.00 0.00 C ATOM 2011 CG1 ILE B 25 14.488 -32.638 -7.578 1.00 0.00 C ATOM 2012 CG2 ILE B 25 14.589 -34.206 -5.632 1.00 0.00 C ATOM 2013 CD1 ILE B 25 15.320 -31.476 -8.067 1.00 0.00 C ATOM 0 H ILE B 25 12.740 -34.032 -4.528 1.00 0.00 H new ATOM 0 HA ILE B 25 13.566 -31.361 -4.862 1.00 0.00 H new ATOM 0 HB ILE B 25 15.183 -32.149 -5.669 1.00 0.00 H new ATOM 0 HG12 ILE B 25 14.914 -33.561 -7.972 1.00 0.00 H new ATOM 0 HG13 ILE B 25 13.485 -32.547 -7.994 1.00 0.00 H new ATOM 0 HG21 ILE B 25 15.495 -34.597 -6.094 1.00 0.00 H new ATOM 0 HG22 ILE B 25 14.688 -34.246 -4.547 1.00 0.00 H new ATOM 0 HG23 ILE B 25 13.735 -34.809 -5.940 1.00 0.00 H new ATOM 0 HD11 ILE B 25 15.338 -31.474 -9.157 1.00 0.00 H new ATOM 0 HD12 ILE B 25 14.886 -30.542 -7.710 1.00 0.00 H new ATOM 0 HD13 ILE B 25 16.337 -31.572 -7.688 1.00 0.00 H new ATOM 2025 N GLY B 26 12.299 -30.231 -6.659 1.00 0.00 N ATOM 2026 CA GLY B 26 11.440 -29.483 -7.544 1.00 0.00 C ATOM 2027 C GLY B 26 10.370 -28.704 -6.781 1.00 0.00 C ATOM 2028 O GLY B 26 9.818 -27.754 -7.327 1.00 0.00 O ATOM 0 H GLY B 26 13.008 -29.662 -6.196 1.00 0.00 H new ATOM 0 HA2 GLY B 26 12.041 -28.791 -8.133 1.00 0.00 H new ATOM 0 HA3 GLY B 26 10.960 -30.165 -8.246 1.00 0.00 H new ATOM 2032 N ASP B 27 10.053 -29.128 -5.575 1.00 0.00 N ATOM 2033 CA ASP B 27 9.080 -28.452 -4.724 1.00 0.00 C ATOM 2034 C ASP B 27 9.646 -27.100 -4.257 1.00 0.00 C ATOM 2035 O ASP B 27 10.833 -27.000 -3.974 1.00 0.00 O ATOM 2036 CB ASP B 27 8.827 -29.307 -3.475 1.00 0.00 C ATOM 2037 CG ASP B 27 7.595 -30.157 -3.512 1.00 0.00 C ATOM 2038 OD1 ASP B 27 6.978 -30.344 -4.581 1.00 0.00 O ATOM 2039 OD2 ASP B 27 7.212 -30.675 -2.421 1.00 0.00 O ATOM 0 H ASP B 27 10.464 -29.959 -5.149 1.00 0.00 H new ATOM 0 HA ASP B 27 8.160 -28.302 -5.289 1.00 0.00 H new ATOM 0 HB2 ASP B 27 9.689 -29.955 -3.319 1.00 0.00 H new ATOM 0 HB3 ASP B 27 8.765 -28.646 -2.611 1.00 0.00 H new ATOM 2044 N SER B 28 8.789 -26.084 -4.171 1.00 0.00 N ATOM 2045 CA SER B 28 9.291 -24.799 -3.612 1.00 0.00 C ATOM 2046 C SER B 28 9.361 -24.934 -2.108 1.00 0.00 C ATOM 2047 O SER B 28 8.756 -25.859 -1.520 1.00 0.00 O ATOM 2048 CB SER B 28 8.402 -23.632 -4.044 1.00 0.00 C ATOM 2049 OG SER B 28 7.343 -23.444 -3.127 1.00 0.00 O ATOM 0 H SER B 28 7.809 -26.101 -4.455 1.00 0.00 H new ATOM 0 HA SER B 28 10.288 -24.583 -3.997 1.00 0.00 H new ATOM 0 HB2 SER B 28 8.997 -22.721 -4.112 1.00 0.00 H new ATOM 0 HB3 SER B 28 7.999 -23.824 -5.038 1.00 0.00 H new ATOM 0 HG SER B 28 6.786 -22.692 -3.420 1.00 0.00 H new ATOM 2055 N LEU B 29 10.050 -24.016 -1.438 1.00 0.00 N ATOM 2056 CA LEU B 29 10.096 -24.052 0.028 1.00 0.00 C ATOM 2057 C LEU B 29 8.757 -23.688 0.635 1.00 0.00 C ATOM 2058 O LEU B 29 8.407 -24.166 1.715 1.00 0.00 O ATOM 2059 CB LEU B 29 11.240 -23.163 0.521 1.00 0.00 C ATOM 2060 CG LEU B 29 12.604 -23.936 0.507 1.00 0.00 C ATOM 2061 CD1 LEU B 29 13.744 -22.961 0.582 1.00 0.00 C ATOM 2062 CD2 LEU B 29 12.603 -24.915 1.672 1.00 0.00 C ATOM 0 H LEU B 29 10.574 -23.254 -1.869 1.00 0.00 H new ATOM 0 HA LEU B 29 10.298 -25.070 0.361 1.00 0.00 H new ATOM 0 HB2 LEU B 29 11.314 -22.278 -0.110 1.00 0.00 H new ATOM 0 HB3 LEU B 29 11.025 -22.817 1.532 1.00 0.00 H new ATOM 0 HG LEU B 29 12.729 -24.497 -0.419 1.00 0.00 H new ATOM 0 HD11 LEU B 29 14.689 -23.504 0.572 1.00 0.00 H new ATOM 0 HD12 LEU B 29 13.704 -22.287 -0.274 1.00 0.00 H new ATOM 0 HD13 LEU B 29 13.668 -22.383 1.503 1.00 0.00 H new ATOM 0 HD21 LEU B 29 13.543 -25.467 1.685 1.00 0.00 H new ATOM 0 HD22 LEU B 29 12.491 -24.367 2.608 1.00 0.00 H new ATOM 0 HD23 LEU B 29 11.774 -25.614 1.559 1.00 0.00 H new ATOM 2074 N LEU B 30 7.937 -22.947 -0.101 1.00 0.00 N ATOM 2075 CA LEU B 30 6.568 -22.644 0.380 1.00 0.00 C ATOM 2076 C LEU B 30 5.721 -23.911 0.309 1.00 0.00 C ATOM 2077 O LEU B 30 5.004 -24.245 1.262 1.00 0.00 O ATOM 2078 CB LEU B 30 5.956 -21.524 -0.449 1.00 0.00 C ATOM 2079 CG LEU B 30 4.446 -21.292 -0.249 1.00 0.00 C ATOM 2080 CD1 LEU B 30 4.154 -20.935 1.211 1.00 0.00 C ATOM 2081 CD2 LEU B 30 3.932 -20.208 -1.172 1.00 0.00 C ATOM 0 H LEU B 30 8.174 -22.548 -1.010 1.00 0.00 H new ATOM 0 HA LEU B 30 6.606 -22.306 1.416 1.00 0.00 H new ATOM 0 HB2 LEU B 30 6.481 -20.597 -0.217 1.00 0.00 H new ATOM 0 HB3 LEU B 30 6.136 -21.737 -1.503 1.00 0.00 H new ATOM 0 HG LEU B 30 3.925 -22.217 -0.497 1.00 0.00 H new ATOM 0 HD11 LEU B 30 3.084 -20.774 1.339 1.00 0.00 H new ATOM 0 HD12 LEU B 30 4.478 -21.751 1.857 1.00 0.00 H new ATOM 0 HD13 LEU B 30 4.693 -20.026 1.478 1.00 0.00 H new ATOM 0 HD21 LEU B 30 2.864 -20.067 -1.008 1.00 0.00 H new ATOM 0 HD22 LEU B 30 4.457 -19.275 -0.966 1.00 0.00 H new ATOM 0 HD23 LEU B 30 4.104 -20.500 -2.208 1.00 0.00 H new ATOM 2093 N ASP B 31 5.870 -24.644 -0.792 1.00 0.00 N ATOM 2094 CA ASP B 31 5.225 -25.949 -0.937 1.00 0.00 C ATOM 2095 C ASP B 31 5.566 -26.843 0.256 1.00 0.00 C ATOM 2096 O ASP B 31 4.684 -27.418 0.892 1.00 0.00 O ATOM 2097 CB ASP B 31 5.644 -26.650 -2.216 1.00 0.00 C ATOM 2098 CG ASP B 31 5.252 -25.944 -3.492 1.00 0.00 C ATOM 2099 OD1 ASP B 31 4.252 -25.208 -3.498 1.00 0.00 O ATOM 2100 OD2 ASP B 31 5.961 -26.133 -4.517 1.00 0.00 O ATOM 0 H ASP B 31 6.430 -24.359 -1.595 1.00 0.00 H new ATOM 0 HA ASP B 31 4.150 -25.772 -0.979 1.00 0.00 H new ATOM 0 HB2 ASP B 31 6.727 -26.774 -2.206 1.00 0.00 H new ATOM 0 HB3 ASP B 31 5.209 -27.649 -2.224 1.00 0.00 H new ATOM 2105 N VAL B 32 6.853 -26.875 0.615 1.00 0.00 N ATOM 2106 CA VAL B 32 7.297 -27.642 1.763 1.00 0.00 C ATOM 2107 C VAL B 32 6.573 -27.219 3.032 1.00 0.00 C ATOM 2108 O VAL B 32 6.182 -28.066 3.857 1.00 0.00 O ATOM 2109 CB VAL B 32 8.818 -27.536 1.985 1.00 0.00 C ATOM 2110 CG1 VAL B 32 9.242 -28.368 3.189 1.00 0.00 C ATOM 2111 CG2 VAL B 32 9.572 -27.988 0.739 1.00 0.00 C ATOM 0 H VAL B 32 7.596 -26.378 0.124 1.00 0.00 H new ATOM 0 HA VAL B 32 7.054 -28.681 1.541 1.00 0.00 H new ATOM 0 HB VAL B 32 9.064 -26.492 2.181 1.00 0.00 H new ATOM 0 HG11 VAL B 32 10.319 -28.281 3.330 1.00 0.00 H new ATOM 0 HG12 VAL B 32 8.729 -28.006 4.080 1.00 0.00 H new ATOM 0 HG13 VAL B 32 8.982 -29.413 3.019 1.00 0.00 H new ATOM 0 HG21 VAL B 32 10.645 -27.907 0.913 1.00 0.00 H new ATOM 0 HG22 VAL B 32 9.318 -29.024 0.516 1.00 0.00 H new ATOM 0 HG23 VAL B 32 9.293 -27.357 -0.104 1.00 0.00 H new ATOM 2121 N VAL B 33 6.457 -25.907 3.247 1.00 0.00 N ATOM 2122 CA VAL B 33 5.804 -25.431 4.464 1.00 0.00 C ATOM 2123 C VAL B 33 4.315 -25.737 4.424 1.00 0.00 C ATOM 2124 O VAL B 33 3.748 -26.206 5.425 1.00 0.00 O ATOM 2125 CB VAL B 33 6.058 -23.934 4.703 1.00 0.00 C ATOM 2126 CG1 VAL B 33 5.167 -23.383 5.794 1.00 0.00 C ATOM 2127 CG2 VAL B 33 7.539 -23.737 5.104 1.00 0.00 C ATOM 0 H VAL B 33 6.794 -25.179 2.618 1.00 0.00 H new ATOM 0 HA VAL B 33 6.243 -25.966 5.306 1.00 0.00 H new ATOM 0 HB VAL B 33 5.831 -23.396 3.783 1.00 0.00 H new ATOM 0 HG11 VAL B 33 5.376 -22.322 5.934 1.00 0.00 H new ATOM 0 HG12 VAL B 33 4.122 -23.513 5.511 1.00 0.00 H new ATOM 0 HG13 VAL B 33 5.359 -23.916 6.725 1.00 0.00 H new ATOM 0 HG21 VAL B 33 7.732 -22.678 5.276 1.00 0.00 H new ATOM 0 HG22 VAL B 33 7.747 -24.297 6.016 1.00 0.00 H new ATOM 0 HG23 VAL B 33 8.184 -24.097 4.303 1.00 0.00 H new ATOM 2137 N VAL B 34 3.685 -25.496 3.287 1.00 0.00 N ATOM 2138 CA VAL B 34 2.222 -25.643 3.185 1.00 0.00 C ATOM 2139 C VAL B 34 1.775 -27.075 3.273 1.00 0.00 C ATOM 2140 O VAL B 34 0.934 -27.424 4.133 1.00 0.00 O ATOM 2141 CB VAL B 34 1.711 -24.924 1.934 1.00 0.00 C ATOM 2142 CG1 VAL B 34 0.335 -25.381 1.508 1.00 0.00 C ATOM 2143 CG2 VAL B 34 1.718 -23.405 2.181 1.00 0.00 C ATOM 0 H VAL B 34 4.145 -25.201 2.426 1.00 0.00 H new ATOM 0 HA VAL B 34 1.768 -25.161 4.051 1.00 0.00 H new ATOM 0 HB VAL B 34 2.384 -25.177 1.115 1.00 0.00 H new ATOM 0 HG11 VAL B 34 0.030 -24.834 0.616 1.00 0.00 H new ATOM 0 HG12 VAL B 34 0.358 -26.448 1.289 1.00 0.00 H new ATOM 0 HG13 VAL B 34 -0.377 -25.191 2.312 1.00 0.00 H new ATOM 0 HG21 VAL B 34 1.355 -22.890 1.292 1.00 0.00 H new ATOM 0 HG22 VAL B 34 1.071 -23.171 3.026 1.00 0.00 H new ATOM 0 HG23 VAL B 34 2.734 -23.077 2.401 1.00 0.00 H new ATOM 2153 N GLN B 35 2.376 -27.985 2.508 1.00 0.00 N ATOM 2154 CA GLN B 35 1.976 -29.378 2.517 1.00 0.00 C ATOM 2155 C GLN B 35 2.154 -30.055 3.857 1.00 0.00 C ATOM 2156 O GLN B 35 1.299 -30.843 4.287 1.00 0.00 O ATOM 2157 CB GLN B 35 2.702 -30.165 1.426 1.00 0.00 C ATOM 2158 CG GLN B 35 1.943 -30.129 0.090 1.00 0.00 C ATOM 2159 CD GLN B 35 2.888 -29.845 -1.059 1.00 0.00 C ATOM 2160 OE1 GLN B 35 3.900 -30.540 -1.203 1.00 0.00 O ATOM 2161 NE2 GLN B 35 2.590 -28.829 -1.848 1.00 0.00 N ATOM 0 H GLN B 35 3.146 -27.774 1.873 1.00 0.00 H new ATOM 0 HA GLN B 35 0.905 -29.376 2.312 1.00 0.00 H new ATOM 0 HB2 GLN B 35 3.702 -29.754 1.286 1.00 0.00 H new ATOM 0 HB3 GLN B 35 2.825 -31.200 1.746 1.00 0.00 H new ATOM 0 HG2 GLN B 35 1.441 -31.082 -0.074 1.00 0.00 H new ATOM 0 HG3 GLN B 35 1.168 -29.363 0.127 1.00 0.00 H new ATOM 0 HE21 GLN B 35 1.741 -28.288 -1.684 1.00 0.00 H new ATOM 0 HE22 GLN B 35 3.209 -28.585 -2.621 1.00 0.00 H new ATOM 2170 N ASN B 36 3.251 -29.763 4.546 1.00 0.00 N ATOM 2171 CA ASN B 36 3.569 -30.399 5.810 1.00 0.00 C ATOM 2172 C ASN B 36 3.006 -29.676 7.002 1.00 0.00 C ATOM 2173 O ASN B 36 3.383 -29.976 8.147 1.00 0.00 O ATOM 2174 CB ASN B 36 5.094 -30.558 5.946 1.00 0.00 C ATOM 2175 CG ASN B 36 5.707 -31.172 4.710 1.00 0.00 C ATOM 2176 OD1 ASN B 36 5.308 -32.262 4.283 1.00 0.00 O ATOM 2177 ND2 ASN B 36 6.670 -30.496 4.116 1.00 0.00 N ATOM 0 H ASN B 36 3.942 -29.078 4.240 1.00 0.00 H new ATOM 0 HA ASN B 36 3.092 -31.379 5.798 1.00 0.00 H new ATOM 0 HB2 ASN B 36 5.546 -29.583 6.130 1.00 0.00 H new ATOM 0 HB3 ASN B 36 5.319 -31.182 6.811 1.00 0.00 H new ATOM 0 HD21 ASN B 36 7.112 -30.869 3.276 1.00 0.00 H new ATOM 0 HD22 ASN B 36 6.974 -29.600 4.497 1.00 0.00 H new ATOM 2184 N ASN B 37 2.154 -28.676 6.789 1.00 0.00 N ATOM 2185 CA ASN B 37 1.531 -27.913 7.831 1.00 0.00 C ATOM 2186 C ASN B 37 2.510 -27.416 8.881 1.00 0.00 C ATOM 2187 O ASN B 37 2.208 -27.471 10.079 1.00 0.00 O ATOM 2188 CB ASN B 37 0.437 -28.746 8.543 1.00 0.00 C ATOM 2189 CG ASN B 37 -0.867 -28.743 7.771 1.00 0.00 C ATOM 2190 OD1 ASN B 37 -1.394 -27.688 7.423 1.00 0.00 O ATOM 2191 ND2 ASN B 37 -1.378 -29.937 7.498 1.00 0.00 N ATOM 0 H ASN B 37 1.880 -28.377 5.853 1.00 0.00 H new ATOM 0 HA ASN B 37 1.096 -27.045 7.335 1.00 0.00 H new ATOM 0 HB2 ASN B 37 0.784 -29.772 8.666 1.00 0.00 H new ATOM 0 HB3 ASN B 37 0.268 -28.345 9.542 1.00 0.00 H new ATOM 0 HD21 ASN B 37 -2.250 -30.011 6.975 1.00 0.00 H new ATOM 0 HD22 ASN B 37 -0.898 -30.781 7.811 1.00 0.00 H new ATOM 2198 N LEU B 38 3.644 -26.878 8.444 1.00 0.00 N ATOM 2199 CA LEU B 38 4.624 -26.336 9.389 1.00 0.00 C ATOM 2200 C LEU B 38 4.054 -25.138 10.119 1.00 0.00 C ATOM 2201 O LEU B 38 3.380 -24.290 9.521 1.00 0.00 O ATOM 2202 CB LEU B 38 5.916 -26.000 8.635 1.00 0.00 C ATOM 2203 CG LEU B 38 7.026 -27.041 8.716 1.00 0.00 C ATOM 2204 CD1 LEU B 38 6.485 -28.450 8.505 1.00 0.00 C ATOM 2205 CD2 LEU B 38 8.154 -26.743 7.745 1.00 0.00 C ATOM 0 H LEU B 38 3.908 -26.804 7.461 1.00 0.00 H new ATOM 0 HA LEU B 38 4.859 -27.080 10.150 1.00 0.00 H new ATOM 0 HB2 LEU B 38 5.670 -25.841 7.585 1.00 0.00 H new ATOM 0 HB3 LEU B 38 6.302 -25.055 9.018 1.00 0.00 H new ATOM 0 HG LEU B 38 7.438 -26.986 9.724 1.00 0.00 H new ATOM 0 HD11 LEU B 38 7.303 -29.167 8.569 1.00 0.00 H new ATOM 0 HD12 LEU B 38 5.745 -28.674 9.273 1.00 0.00 H new ATOM 0 HD13 LEU B 38 6.020 -28.518 7.522 1.00 0.00 H new ATOM 0 HD21 LEU B 38 8.924 -27.509 7.836 1.00 0.00 H new ATOM 0 HD22 LEU B 38 7.765 -26.737 6.727 1.00 0.00 H new ATOM 0 HD23 LEU B 38 8.584 -25.768 7.975 1.00 0.00 H new ATOM 2217 N ASP B 39 4.341 -25.024 11.401 1.00 0.00 N ATOM 2218 CA ASP B 39 3.784 -23.961 12.255 1.00 0.00 C ATOM 2219 C ASP B 39 4.589 -22.691 12.182 1.00 0.00 C ATOM 2220 O ASP B 39 5.301 -22.292 13.116 1.00 0.00 O ATOM 2221 CB ASP B 39 3.690 -24.512 13.679 1.00 0.00 C ATOM 2222 CG ASP B 39 3.507 -23.495 14.763 1.00 0.00 C ATOM 2223 OD1 ASP B 39 2.618 -22.619 14.640 1.00 0.00 O ATOM 2224 OD2 ASP B 39 4.285 -23.527 15.756 1.00 0.00 O ATOM 0 H ASP B 39 4.967 -25.661 11.893 1.00 0.00 H new ATOM 0 HA ASP B 39 2.791 -23.683 11.902 1.00 0.00 H new ATOM 0 HB2 ASP B 39 2.857 -25.214 13.722 1.00 0.00 H new ATOM 0 HB3 ASP B 39 4.597 -25.079 13.889 1.00 0.00 H new ATOM 2229 N ILE B 40 4.584 -22.039 10.997 1.00 0.00 N ATOM 2230 CA ILE B 40 5.346 -20.789 10.854 1.00 0.00 C ATOM 2231 C ILE B 40 4.360 -19.651 10.614 1.00 0.00 C ATOM 2232 O ILE B 40 3.740 -19.554 9.562 1.00 0.00 O ATOM 2233 CB ILE B 40 6.424 -20.849 9.786 1.00 0.00 C ATOM 2234 CG1 ILE B 40 7.403 -22.005 10.033 1.00 0.00 C ATOM 2235 CG2 ILE B 40 7.206 -19.533 9.737 1.00 0.00 C ATOM 2236 CD1 ILE B 40 8.086 -22.513 8.767 1.00 0.00 C ATOM 0 H ILE B 40 4.083 -22.344 10.163 1.00 0.00 H new ATOM 0 HA ILE B 40 5.897 -20.616 11.779 1.00 0.00 H new ATOM 0 HB ILE B 40 5.922 -21.016 8.833 1.00 0.00 H new ATOM 0 HG12 ILE B 40 8.165 -21.679 10.740 1.00 0.00 H new ATOM 0 HG13 ILE B 40 6.866 -22.830 10.501 1.00 0.00 H new ATOM 0 HG21 ILE B 40 7.974 -19.595 8.966 1.00 0.00 H new ATOM 0 HG22 ILE B 40 6.525 -18.714 9.506 1.00 0.00 H new ATOM 0 HG23 ILE B 40 7.676 -19.353 10.704 1.00 0.00 H new ATOM 0 HD11 ILE B 40 8.762 -23.329 9.021 1.00 0.00 H new ATOM 0 HD12 ILE B 40 7.332 -22.871 8.066 1.00 0.00 H new ATOM 0 HD13 ILE B 40 8.652 -21.702 8.308 1.00 0.00 H new ATOM 2248 N ASP B 41 4.162 -18.850 11.660 1.00 0.00 N ATOM 2249 CA ASP B 41 3.150 -17.795 11.612 1.00 0.00 C ATOM 2250 C ASP B 41 3.285 -16.952 10.349 1.00 0.00 C ATOM 2251 O ASP B 41 4.365 -16.482 9.985 1.00 0.00 O ATOM 2252 CB ASP B 41 3.225 -16.911 12.845 1.00 0.00 C ATOM 2253 CG ASP B 41 2.966 -17.665 14.138 1.00 0.00 C ATOM 2254 OD1 ASP B 41 2.292 -18.711 14.101 1.00 0.00 O ATOM 2255 OD2 ASP B 41 3.490 -17.212 15.177 1.00 0.00 O ATOM 0 H ASP B 41 4.679 -18.909 12.537 1.00 0.00 H new ATOM 0 HA ASP B 41 2.175 -18.281 11.593 1.00 0.00 H new ATOM 0 HB2 ASP B 41 4.211 -16.448 12.893 1.00 0.00 H new ATOM 0 HB3 ASP B 41 2.498 -16.104 12.751 1.00 0.00 H new ATOM 2260 N GLY B 42 2.183 -16.824 9.628 1.00 0.00 N ATOM 2261 CA GLY B 42 2.011 -16.022 8.478 1.00 0.00 C ATOM 2262 C GLY B 42 2.686 -16.467 7.216 1.00 0.00 C ATOM 2263 O GLY B 42 2.591 -15.776 6.184 1.00 0.00 O ATOM 0 H GLY B 42 1.330 -17.329 9.871 1.00 0.00 H new ATOM 0 HA2 GLY B 42 0.942 -15.945 8.279 1.00 0.00 H new ATOM 0 HA3 GLY B 42 2.365 -15.018 8.712 1.00 0.00 H new ATOM 2267 N PHE B 43 3.401 -17.586 7.237 1.00 0.00 N ATOM 2268 CA PHE B 43 4.245 -17.945 6.083 1.00 0.00 C ATOM 2269 C PHE B 43 3.434 -18.240 4.856 1.00 0.00 C ATOM 2270 O PHE B 43 2.510 -19.086 4.885 1.00 0.00 O ATOM 2271 CB PHE B 43 5.158 -19.106 6.491 1.00 0.00 C ATOM 2272 CG PHE B 43 6.316 -19.340 5.571 1.00 0.00 C ATOM 2273 CD1 PHE B 43 6.160 -20.019 4.387 1.00 0.00 C ATOM 2274 CD2 PHE B 43 7.593 -18.919 5.934 1.00 0.00 C ATOM 2275 CE1 PHE B 43 7.234 -20.276 3.554 1.00 0.00 C ATOM 2276 CE2 PHE B 43 8.677 -19.171 5.118 1.00 0.00 C ATOM 2277 CZ PHE B 43 8.501 -19.840 3.922 1.00 0.00 C ATOM 0 H PHE B 43 3.421 -18.249 8.012 1.00 0.00 H new ATOM 0 HA PHE B 43 4.865 -17.093 5.806 1.00 0.00 H new ATOM 0 HB2 PHE B 43 5.540 -18.916 7.494 1.00 0.00 H new ATOM 0 HB3 PHE B 43 4.563 -20.018 6.544 1.00 0.00 H new ATOM 0 HD1 PHE B 43 5.176 -20.360 4.100 1.00 0.00 H new ATOM 0 HD2 PHE B 43 7.736 -18.390 6.864 1.00 0.00 H new ATOM 0 HE1 PHE B 43 7.089 -20.810 2.627 1.00 0.00 H new ATOM 0 HE2 PHE B 43 9.663 -18.845 5.414 1.00 0.00 H new ATOM 0 HZ PHE B 43 9.346 -20.024 3.275 1.00 0.00 H new ATOM 2287 N GLY B 44 3.726 -17.568 3.740 1.00 0.00 N ATOM 2288 CA GLY B 44 3.058 -17.873 2.473 1.00 0.00 C ATOM 2289 C GLY B 44 1.783 -17.066 2.273 1.00 0.00 C ATOM 2290 O GLY B 44 0.902 -17.468 1.490 1.00 0.00 O ATOM 0 H GLY B 44 4.414 -16.816 3.687 1.00 0.00 H new ATOM 0 HA2 GLY B 44 3.743 -17.674 1.649 1.00 0.00 H new ATOM 0 HA3 GLY B 44 2.820 -18.936 2.439 1.00 0.00 H new ATOM 2294 N ALA B 45 1.714 -15.889 2.855 1.00 0.00 N ATOM 2295 CA ALA B 45 0.535 -15.034 2.791 1.00 0.00 C ATOM 2296 C ALA B 45 -0.045 -14.851 1.421 1.00 0.00 C ATOM 2297 O ALA B 45 -1.282 -14.998 1.247 1.00 0.00 O ATOM 2298 CB ALA B 45 0.863 -13.687 3.447 1.00 0.00 C ATOM 0 H ALA B 45 2.481 -15.488 3.394 1.00 0.00 H new ATOM 0 HA ALA B 45 -0.254 -15.548 3.340 1.00 0.00 H new ATOM 0 HB1 ALA B 45 -0.012 -13.039 3.405 1.00 0.00 H new ATOM 0 HB2 ALA B 45 1.145 -13.848 4.487 1.00 0.00 H new ATOM 0 HB3 ALA B 45 1.690 -13.215 2.916 1.00 0.00 H new ATOM 2304 N CYS B 46 0.730 -14.472 0.416 1.00 0.00 N ATOM 2305 CA CYS B 46 0.264 -14.287 -0.947 1.00 0.00 C ATOM 2306 C CYS B 46 0.228 -15.571 -1.753 1.00 0.00 C ATOM 2307 O CYS B 46 -0.031 -15.551 -2.969 1.00 0.00 O ATOM 2308 CB CYS B 46 1.046 -13.206 -1.682 1.00 0.00 C ATOM 2309 SG CYS B 46 2.658 -13.644 -2.371 1.00 0.00 S ATOM 0 H CYS B 46 1.725 -14.280 0.530 1.00 0.00 H new ATOM 0 HA CYS B 46 -0.768 -13.950 -0.851 1.00 0.00 H new ATOM 0 HB2 CYS B 46 0.423 -12.840 -2.498 1.00 0.00 H new ATOM 0 HB3 CYS B 46 1.192 -12.374 -0.994 1.00 0.00 H new ATOM 2314 N GLU B 47 0.503 -16.707 -1.121 1.00 0.00 N ATOM 2315 CA GLU B 47 0.500 -17.992 -1.810 1.00 0.00 C ATOM 2316 C GLU B 47 1.416 -17.966 -3.021 1.00 0.00 C ATOM 2317 O GLU B 47 1.065 -18.415 -4.111 1.00 0.00 O ATOM 2318 CB GLU B 47 -0.936 -18.358 -2.224 1.00 0.00 C ATOM 2319 CG GLU B 47 -1.839 -18.664 -1.033 1.00 0.00 C ATOM 2320 CD GLU B 47 -3.310 -18.652 -1.401 1.00 0.00 C ATOM 2321 OE1 GLU B 47 -3.876 -17.545 -1.538 1.00 0.00 O ATOM 2322 OE2 GLU B 47 -3.899 -19.742 -1.552 1.00 0.00 O ATOM 0 H GLU B 47 0.732 -16.764 -0.129 1.00 0.00 H new ATOM 0 HA GLU B 47 0.878 -18.752 -1.126 1.00 0.00 H new ATOM 0 HB2 GLU B 47 -1.364 -17.535 -2.796 1.00 0.00 H new ATOM 0 HB3 GLU B 47 -0.908 -19.225 -2.884 1.00 0.00 H new ATOM 0 HG2 GLU B 47 -1.578 -19.640 -0.625 1.00 0.00 H new ATOM 0 HG3 GLU B 47 -1.659 -17.931 -0.247 1.00 0.00 H new ATOM 2329 N GLY B 48 2.616 -17.400 -2.852 1.00 0.00 N ATOM 2330 CA GLY B 48 3.643 -17.353 -3.818 1.00 0.00 C ATOM 2331 C GLY B 48 3.442 -16.561 -5.072 1.00 0.00 C ATOM 2332 O GLY B 48 3.849 -17.024 -6.164 1.00 0.00 O ATOM 0 H GLY B 48 2.880 -16.946 -1.978 1.00 0.00 H new ATOM 0 HA2 GLY B 48 4.535 -16.965 -3.327 1.00 0.00 H new ATOM 0 HA3 GLY B 48 3.862 -18.380 -4.112 1.00 0.00 H new ATOM 2336 N THR B 49 2.980 -15.319 -4.998 1.00 0.00 N ATOM 2337 CA THR B 49 2.811 -14.475 -6.176 1.00 0.00 C ATOM 2338 C THR B 49 3.665 -13.225 -6.101 1.00 0.00 C ATOM 2339 O THR B 49 3.412 -12.228 -6.787 1.00 0.00 O ATOM 2340 CB THR B 49 1.330 -14.054 -6.360 1.00 0.00 C ATOM 2341 OG1 THR B 49 0.928 -13.295 -5.215 1.00 0.00 O ATOM 2342 CG2 THR B 49 0.432 -15.260 -6.529 1.00 0.00 C ATOM 0 H THR B 49 2.712 -14.869 -4.123 1.00 0.00 H new ATOM 0 HA THR B 49 3.130 -15.073 -7.029 1.00 0.00 H new ATOM 0 HB THR B 49 1.240 -13.451 -7.264 1.00 0.00 H new ATOM 0 HG1 THR B 49 1.567 -13.439 -4.486 1.00 0.00 H new ATOM 0 HG21 THR B 49 -0.599 -14.931 -6.656 1.00 0.00 H new ATOM 0 HG22 THR B 49 0.743 -15.825 -7.408 1.00 0.00 H new ATOM 0 HG23 THR B 49 0.504 -15.894 -5.645 1.00 0.00 H new ATOM 2350 N LEU B 50 4.648 -13.220 -5.192 1.00 0.00 N ATOM 2351 CA LEU B 50 5.524 -12.081 -5.018 1.00 0.00 C ATOM 2352 C LEU B 50 4.784 -10.811 -4.654 1.00 0.00 C ATOM 2353 O LEU B 50 5.125 -9.714 -5.112 1.00 0.00 O ATOM 2354 CB LEU B 50 6.409 -11.884 -6.251 1.00 0.00 C ATOM 2355 CG LEU B 50 7.411 -13.027 -6.517 1.00 0.00 C ATOM 2356 CD1 LEU B 50 8.291 -12.699 -7.706 1.00 0.00 C ATOM 2357 CD2 LEU B 50 8.275 -13.248 -5.268 1.00 0.00 C ATOM 0 H LEU B 50 4.848 -14.002 -4.568 1.00 0.00 H new ATOM 0 HA LEU B 50 6.165 -12.305 -4.166 1.00 0.00 H new ATOM 0 HB2 LEU B 50 5.769 -11.770 -7.126 1.00 0.00 H new ATOM 0 HB3 LEU B 50 6.964 -10.952 -6.138 1.00 0.00 H new ATOM 0 HG LEU B 50 6.857 -13.938 -6.743 1.00 0.00 H new ATOM 0 HD11 LEU B 50 8.991 -13.517 -7.877 1.00 0.00 H new ATOM 0 HD12 LEU B 50 7.670 -12.561 -8.591 1.00 0.00 H new ATOM 0 HD13 LEU B 50 8.846 -11.783 -7.506 1.00 0.00 H new ATOM 0 HD21 LEU B 50 8.984 -14.055 -5.454 1.00 0.00 H new ATOM 0 HD22 LEU B 50 8.820 -12.333 -5.036 1.00 0.00 H new ATOM 0 HD23 LEU B 50 7.636 -13.513 -4.426 1.00 0.00 H new ATOM 2369 N ALA B 51 3.856 -10.922 -3.708 1.00 0.00 N ATOM 2370 CA ALA B 51 3.121 -9.752 -3.215 1.00 0.00 C ATOM 2371 C ALA B 51 3.228 -9.672 -1.699 1.00 0.00 C ATOM 2372 O ALA B 51 2.423 -9.024 -1.036 1.00 0.00 O ATOM 2373 CB ALA B 51 1.652 -9.855 -3.628 1.00 0.00 C ATOM 0 H ALA B 51 3.593 -11.803 -3.267 1.00 0.00 H new ATOM 0 HA ALA B 51 3.553 -8.850 -3.648 1.00 0.00 H new ATOM 0 HB1 ALA B 51 1.109 -8.984 -3.260 1.00 0.00 H new ATOM 0 HB2 ALA B 51 1.582 -9.894 -4.715 1.00 0.00 H new ATOM 0 HB3 ALA B 51 1.217 -10.760 -3.203 1.00 0.00 H new ATOM 2379 N CYS B 52 4.199 -10.416 -1.140 1.00 0.00 N ATOM 2380 CA CYS B 52 4.344 -10.409 0.331 1.00 0.00 C ATOM 2381 C CYS B 52 5.783 -10.732 0.711 1.00 0.00 C ATOM 2382 O CYS B 52 6.593 -10.962 -0.184 1.00 0.00 O ATOM 2383 CB CYS B 52 3.357 -11.379 0.953 1.00 0.00 C ATOM 2384 SG CYS B 52 3.861 -13.111 1.060 1.00 0.00 S ATOM 0 H CYS B 52 4.863 -11.000 -1.648 1.00 0.00 H new ATOM 0 HA CYS B 52 4.117 -9.417 0.720 1.00 0.00 H new ATOM 0 HB2 CYS B 52 3.129 -11.030 1.960 1.00 0.00 H new ATOM 0 HB3 CYS B 52 2.430 -11.331 0.382 1.00 0.00 H new ATOM 2389 N SER B 53 6.131 -10.584 2.002 1.00 0.00 N ATOM 2390 CA SER B 53 7.530 -10.928 2.366 1.00 0.00 C ATOM 2391 C SER B 53 7.559 -12.047 3.390 1.00 0.00 C ATOM 2392 O SER B 53 8.614 -12.324 3.976 1.00 0.00 O ATOM 2393 CB SER B 53 8.245 -9.688 2.888 1.00 0.00 C ATOM 2394 OG SER B 53 7.616 -9.147 4.029 1.00 0.00 O ATOM 0 H SER B 53 5.528 -10.258 2.758 1.00 0.00 H new ATOM 0 HA SER B 53 8.051 -11.282 1.477 1.00 0.00 H new ATOM 0 HB2 SER B 53 9.277 -9.942 3.131 1.00 0.00 H new ATOM 0 HB3 SER B 53 8.279 -8.933 2.102 1.00 0.00 H new ATOM 0 HG SER B 53 7.536 -8.175 3.929 1.00 0.00 H new ATOM 2400 N THR B 54 6.434 -12.713 3.618 1.00 0.00 N ATOM 2401 CA THR B 54 6.291 -13.672 4.681 1.00 0.00 C ATOM 2402 C THR B 54 7.005 -14.988 4.450 1.00 0.00 C ATOM 2403 O THR B 54 7.108 -15.787 5.391 1.00 0.00 O ATOM 2404 CB THR B 54 4.793 -13.999 4.975 1.00 0.00 C ATOM 2405 OG1 THR B 54 4.258 -14.728 3.853 1.00 0.00 O ATOM 2406 CG2 THR B 54 4.011 -12.697 5.124 1.00 0.00 C ATOM 0 H THR B 54 5.591 -12.593 3.057 1.00 0.00 H new ATOM 0 HA THR B 54 6.761 -13.175 5.530 1.00 0.00 H new ATOM 0 HB THR B 54 4.713 -14.585 5.890 1.00 0.00 H new ATOM 0 HG1 THR B 54 4.187 -14.131 3.079 1.00 0.00 H new ATOM 0 HG21 THR B 54 2.965 -12.923 5.329 1.00 0.00 H new ATOM 0 HG22 THR B 54 4.425 -12.116 5.948 1.00 0.00 H new ATOM 0 HG23 THR B 54 4.084 -12.121 4.201 1.00 0.00 H new ATOM 2414 N CYS B 55 7.427 -15.285 3.230 1.00 0.00 N ATOM 2415 CA CYS B 55 8.101 -16.524 2.926 1.00 0.00 C ATOM 2416 C CYS B 55 9.620 -16.333 2.886 1.00 0.00 C ATOM 2417 O CYS B 55 10.360 -17.225 2.490 1.00 0.00 O ATOM 2418 CB CYS B 55 7.647 -17.042 1.530 1.00 0.00 C ATOM 2419 SG CYS B 55 8.185 -15.962 0.206 1.00 0.00 S ATOM 0 H CYS B 55 7.308 -14.668 2.426 1.00 0.00 H new ATOM 0 HA CYS B 55 7.845 -17.239 3.708 1.00 0.00 H new ATOM 0 HB2 CYS B 55 8.047 -18.043 1.367 1.00 0.00 H new ATOM 0 HB3 CYS B 55 6.560 -17.126 1.510 1.00 0.00 H new ATOM 2424 N HIS B 56 10.064 -15.212 3.428 1.00 0.00 N ATOM 2425 CA HIS B 56 11.496 -14.918 3.536 1.00 0.00 C ATOM 2426 C HIS B 56 12.198 -15.999 4.367 1.00 0.00 C ATOM 2427 O HIS B 56 11.789 -16.309 5.476 1.00 0.00 O ATOM 2428 CB HIS B 56 11.654 -13.531 4.154 1.00 0.00 C ATOM 2429 CG HIS B 56 13.021 -13.110 4.568 1.00 0.00 C ATOM 2430 ND1 HIS B 56 13.216 -12.191 5.580 1.00 0.00 N ATOM 2431 CD2 HIS B 56 14.252 -13.433 4.124 1.00 0.00 C ATOM 2432 CE1 HIS B 56 14.515 -11.993 5.760 1.00 0.00 C ATOM 2433 NE2 HIS B 56 15.179 -12.727 4.890 1.00 0.00 N ATOM 0 H HIS B 56 9.457 -14.484 3.803 1.00 0.00 H new ATOM 0 HA HIS B 56 11.965 -14.921 2.552 1.00 0.00 H new ATOM 0 HB2 HIS B 56 11.280 -12.800 3.437 1.00 0.00 H new ATOM 0 HB3 HIS B 56 11.007 -13.478 5.030 1.00 0.00 H new ATOM 0 HD1 HIS B 56 12.473 -11.734 6.109 1.00 0.00 H new ATOM 0 HD2 HIS B 56 14.480 -14.116 3.319 1.00 0.00 H new ATOM 0 HE1 HIS B 56 14.956 -11.339 6.498 1.00 0.00 H new ATOM 2441 N LEU B 57 13.292 -16.528 3.825 1.00 0.00 N ATOM 2442 CA LEU B 57 14.122 -17.499 4.544 1.00 0.00 C ATOM 2443 C LEU B 57 15.594 -17.074 4.424 1.00 0.00 C ATOM 2444 O LEU B 57 15.977 -16.443 3.444 1.00 0.00 O ATOM 2445 CB LEU B 57 13.959 -18.907 4.004 1.00 0.00 C ATOM 2446 CG LEU B 57 12.596 -19.584 4.232 1.00 0.00 C ATOM 2447 CD1 LEU B 57 12.409 -20.757 3.295 1.00 0.00 C ATOM 2448 CD2 LEU B 57 12.441 -19.985 5.689 1.00 0.00 C ATOM 0 H LEU B 57 13.627 -16.302 2.889 1.00 0.00 H new ATOM 0 HA LEU B 57 13.802 -17.511 5.586 1.00 0.00 H new ATOM 0 HB2 LEU B 57 14.152 -18.884 2.931 1.00 0.00 H new ATOM 0 HB3 LEU B 57 14.729 -19.534 4.453 1.00 0.00 H new ATOM 0 HG LEU B 57 11.807 -18.868 4.003 1.00 0.00 H new ATOM 0 HD11 LEU B 57 11.438 -21.217 3.477 1.00 0.00 H new ATOM 0 HD12 LEU B 57 12.458 -20.410 2.263 1.00 0.00 H new ATOM 0 HD13 LEU B 57 13.196 -21.490 3.469 1.00 0.00 H new ATOM 0 HD21 LEU B 57 11.472 -20.462 5.834 1.00 0.00 H new ATOM 0 HD22 LEU B 57 13.233 -20.682 5.961 1.00 0.00 H new ATOM 0 HD23 LEU B 57 12.506 -19.098 6.319 1.00 0.00 H new ATOM 2460 N ILE B 58 16.375 -17.445 5.405 1.00 0.00 N ATOM 2461 CA ILE B 58 17.801 -17.164 5.461 1.00 0.00 C ATOM 2462 C ILE B 58 18.555 -18.502 5.282 1.00 0.00 C ATOM 2463 O ILE B 58 18.262 -19.463 6.005 1.00 0.00 O ATOM 2464 CB ILE B 58 18.168 -16.586 6.857 1.00 0.00 C ATOM 2465 CG1 ILE B 58 17.485 -15.227 7.041 1.00 0.00 C ATOM 2466 CG2 ILE B 58 19.688 -16.459 6.952 1.00 0.00 C ATOM 2467 CD1 ILE B 58 17.366 -14.823 8.508 1.00 0.00 C ATOM 0 H ILE B 58 16.035 -17.966 6.213 1.00 0.00 H new ATOM 0 HA ILE B 58 18.069 -16.447 4.685 1.00 0.00 H new ATOM 0 HB ILE B 58 17.821 -17.249 7.650 1.00 0.00 H new ATOM 0 HG12 ILE B 58 18.049 -14.465 6.503 1.00 0.00 H new ATOM 0 HG13 ILE B 58 16.491 -15.261 6.596 1.00 0.00 H new ATOM 0 HG21 ILE B 58 19.959 -16.054 7.927 1.00 0.00 H new ATOM 0 HG22 ILE B 58 20.144 -17.441 6.827 1.00 0.00 H new ATOM 0 HG23 ILE B 58 20.047 -15.791 6.169 1.00 0.00 H new ATOM 0 HD11 ILE B 58 16.875 -13.853 8.579 1.00 0.00 H new ATOM 0 HD12 ILE B 58 16.778 -15.568 9.044 1.00 0.00 H new ATOM 0 HD13 ILE B 58 18.360 -14.760 8.950 1.00 0.00 H new ATOM 2479 N PHE B 59 19.357 -18.571 4.235 1.00 0.00 N ATOM 2480 CA PHE B 59 19.980 -19.820 3.812 1.00 0.00 C ATOM 2481 C PHE B 59 21.424 -19.938 4.291 1.00 0.00 C ATOM 2482 O PHE B 59 22.064 -18.932 4.593 1.00 0.00 O ATOM 2483 CB PHE B 59 20.018 -19.794 2.232 1.00 0.00 C ATOM 2484 CG PHE B 59 18.615 -19.989 1.690 1.00 0.00 C ATOM 2485 CD1 PHE B 59 17.739 -18.927 1.603 1.00 0.00 C ATOM 2486 CD2 PHE B 59 18.171 -21.261 1.361 1.00 0.00 C ATOM 2487 CE1 PHE B 59 16.438 -19.115 1.182 1.00 0.00 C ATOM 2488 CE2 PHE B 59 16.866 -21.455 0.932 1.00 0.00 C ATOM 2489 CZ PHE B 59 16.010 -20.383 0.829 1.00 0.00 C ATOM 0 H PHE B 59 19.597 -17.768 3.653 1.00 0.00 H new ATOM 0 HA PHE B 59 19.411 -20.653 4.226 1.00 0.00 H new ATOM 0 HB2 PHE B 59 20.426 -18.845 1.883 1.00 0.00 H new ATOM 0 HB3 PHE B 59 20.676 -20.580 1.860 1.00 0.00 H new ATOM 0 HD1 PHE B 59 18.075 -17.935 1.868 1.00 0.00 H new ATOM 0 HD2 PHE B 59 18.843 -22.103 1.439 1.00 0.00 H new ATOM 0 HE1 PHE B 59 15.758 -18.278 1.128 1.00 0.00 H new ATOM 0 HE2 PHE B 59 16.522 -22.447 0.679 1.00 0.00 H new ATOM 0 HZ PHE B 59 15.002 -20.531 0.472 1.00 0.00 H new ATOM 2499 N GLU B 60 21.928 -21.178 4.325 1.00 0.00 N ATOM 2500 CA GLU B 60 23.377 -21.377 4.541 1.00 0.00 C ATOM 2501 C GLU B 60 24.134 -20.775 3.354 1.00 0.00 C ATOM 2502 O GLU B 60 23.677 -20.903 2.212 1.00 0.00 O ATOM 2503 CB GLU B 60 23.703 -22.857 4.646 1.00 0.00 C ATOM 2504 CG GLU B 60 23.076 -23.572 5.844 1.00 0.00 C ATOM 2505 CD GLU B 60 23.360 -25.067 5.795 1.00 0.00 C ATOM 2506 OE1 GLU B 60 24.568 -25.443 5.741 1.00 0.00 O ATOM 2507 OE2 GLU B 60 22.407 -25.852 5.816 1.00 0.00 O ATOM 0 H GLU B 60 21.383 -22.033 4.211 1.00 0.00 H new ATOM 0 HA GLU B 60 23.673 -20.890 5.470 1.00 0.00 H new ATOM 0 HB2 GLU B 60 23.373 -23.352 3.733 1.00 0.00 H new ATOM 0 HB3 GLU B 60 24.786 -22.973 4.698 1.00 0.00 H new ATOM 0 HG2 GLU B 60 23.471 -23.153 6.770 1.00 0.00 H new ATOM 0 HG3 GLU B 60 21.999 -23.402 5.851 1.00 0.00 H new ATOM 2514 N GLN B 61 25.319 -20.226 3.598 1.00 0.00 N ATOM 2515 CA GLN B 61 26.055 -19.562 2.512 1.00 0.00 C ATOM 2516 C GLN B 61 26.334 -20.470 1.329 1.00 0.00 C ATOM 2517 O GLN B 61 26.084 -20.062 0.170 1.00 0.00 O ATOM 2518 CB GLN B 61 27.343 -18.927 3.023 1.00 0.00 C ATOM 2519 CG GLN B 61 28.238 -18.375 1.919 1.00 0.00 C ATOM 2520 CD GLN B 61 27.641 -17.179 1.206 1.00 0.00 C ATOM 2521 OE1 GLN B 61 26.878 -16.395 1.774 1.00 0.00 O ATOM 2522 NE2 GLN B 61 27.998 -17.012 -0.065 1.00 0.00 N ATOM 0 H GLN B 61 25.785 -20.222 4.506 1.00 0.00 H new ATOM 0 HA GLN B 61 25.397 -18.774 2.146 1.00 0.00 H new ATOM 0 HB2 GLN B 61 27.091 -18.120 3.711 1.00 0.00 H new ATOM 0 HB3 GLN B 61 27.901 -19.669 3.593 1.00 0.00 H new ATOM 0 HG2 GLN B 61 29.199 -18.091 2.348 1.00 0.00 H new ATOM 0 HG3 GLN B 61 28.434 -19.163 1.191 1.00 0.00 H new ATOM 0 HE21 GLN B 61 28.631 -17.677 -0.509 1.00 0.00 H new ATOM 0 HE22 GLN B 61 27.638 -16.219 -0.596 1.00 0.00 H new ATOM 2531 N HIS B 62 26.740 -21.699 1.549 1.00 0.00 N ATOM 2532 CA HIS B 62 27.117 -22.584 0.430 1.00 0.00 C ATOM 2533 C HIS B 62 25.918 -22.959 -0.413 1.00 0.00 C ATOM 2534 O HIS B 62 26.027 -23.274 -1.609 1.00 0.00 O ATOM 2535 CB HIS B 62 27.870 -23.793 0.979 1.00 0.00 C ATOM 2536 CG HIS B 62 26.984 -24.789 1.659 1.00 0.00 C ATOM 2537 ND1 HIS B 62 26.426 -25.845 0.980 1.00 0.00 N ATOM 2538 CD2 HIS B 62 26.550 -24.888 2.932 1.00 0.00 C ATOM 2539 CE1 HIS B 62 25.695 -26.572 1.818 1.00 0.00 C ATOM 2540 NE2 HIS B 62 25.743 -25.986 3.014 1.00 0.00 N ATOM 0 H HIS B 62 26.823 -22.121 2.474 1.00 0.00 H new ATOM 0 HA HIS B 62 27.786 -22.053 -0.247 1.00 0.00 H new ATOM 0 HB2 HIS B 62 28.396 -24.285 0.161 1.00 0.00 H new ATOM 0 HB3 HIS B 62 28.627 -23.450 1.685 1.00 0.00 H new ATOM 0 HD2 HIS B 62 26.797 -24.218 3.742 1.00 0.00 H new ATOM 0 HE1 HIS B 62 25.158 -27.476 1.574 1.00 0.00 H new ATOM 0 HE2 HIS B 62 25.257 -26.305 3.852 1.00 0.00 H new ATOM 2548 N ILE B 63 24.737 -22.992 0.201 1.00 0.00 N ATOM 2549 CA ILE B 63 23.482 -23.188 -0.511 1.00 0.00 C ATOM 2550 C ILE B 63 23.102 -21.909 -1.249 1.00 0.00 C ATOM 2551 O ILE B 63 22.891 -21.922 -2.468 1.00 0.00 O ATOM 2552 CB ILE B 63 22.350 -23.582 0.455 1.00 0.00 C ATOM 2553 CG1 ILE B 63 22.587 -24.942 1.091 1.00 0.00 C ATOM 2554 CG2 ILE B 63 21.003 -23.566 -0.269 1.00 0.00 C ATOM 2555 CD1 ILE B 63 22.738 -26.089 0.106 1.00 0.00 C ATOM 0 H ILE B 63 24.626 -22.883 1.209 1.00 0.00 H new ATOM 0 HA ILE B 63 23.621 -23.999 -1.226 1.00 0.00 H new ATOM 0 HB ILE B 63 22.338 -22.844 1.257 1.00 0.00 H new ATOM 0 HG12 ILE B 63 23.486 -24.888 1.705 1.00 0.00 H new ATOM 0 HG13 ILE B 63 21.756 -25.164 1.761 1.00 0.00 H new ATOM 0 HG21 ILE B 63 20.212 -23.847 0.427 1.00 0.00 H new ATOM 0 HG22 ILE B 63 20.809 -22.565 -0.654 1.00 0.00 H new ATOM 0 HG23 ILE B 63 21.026 -24.275 -1.097 1.00 0.00 H new ATOM 0 HD11 ILE B 63 22.903 -27.018 0.652 1.00 0.00 H new ATOM 0 HD12 ILE B 63 21.831 -26.176 -0.493 1.00 0.00 H new ATOM 0 HD13 ILE B 63 23.588 -25.897 -0.549 1.00 0.00 H new ATOM 2567 N PHE B 64 23.091 -20.779 -0.540 1.00 0.00 N ATOM 2568 CA PHE B 64 22.729 -19.495 -1.108 1.00 0.00 C ATOM 2569 C PHE B 64 23.449 -19.173 -2.403 1.00 0.00 C ATOM 2570 O PHE B 64 22.873 -18.550 -3.310 1.00 0.00 O ATOM 2571 CB PHE B 64 22.946 -18.362 -0.101 1.00 0.00 C ATOM 2572 CG PHE B 64 22.595 -16.991 -0.569 1.00 0.00 C ATOM 2573 CD1 PHE B 64 21.277 -16.558 -0.605 1.00 0.00 C ATOM 2574 CD2 PHE B 64 23.591 -16.102 -0.980 1.00 0.00 C ATOM 2575 CE1 PHE B 64 20.954 -15.285 -1.032 1.00 0.00 C ATOM 2576 CE2 PHE B 64 23.268 -14.842 -1.451 1.00 0.00 C ATOM 2577 CZ PHE B 64 21.954 -14.428 -1.459 1.00 0.00 C ATOM 0 H PHE B 64 23.336 -20.737 0.449 1.00 0.00 H new ATOM 0 HA PHE B 64 21.669 -19.577 -1.347 1.00 0.00 H new ATOM 0 HB2 PHE B 64 22.360 -18.580 0.792 1.00 0.00 H new ATOM 0 HB3 PHE B 64 23.994 -18.365 0.197 1.00 0.00 H new ATOM 0 HD1 PHE B 64 20.490 -17.229 -0.294 1.00 0.00 H new ATOM 0 HD2 PHE B 64 24.627 -16.402 -0.929 1.00 0.00 H new ATOM 0 HE1 PHE B 64 19.924 -14.959 -1.033 1.00 0.00 H new ATOM 0 HE2 PHE B 64 24.045 -14.184 -1.812 1.00 0.00 H new ATOM 0 HZ PHE B 64 21.704 -13.434 -1.799 1.00 0.00 H new ATOM 2587 N GLU B 65 24.758 -19.411 -2.454 1.00 0.00 N ATOM 2588 CA GLU B 65 25.558 -19.000 -3.592 1.00 0.00 C ATOM 2589 C GLU B 65 25.274 -19.779 -4.854 1.00 0.00 C ATOM 2590 O GLU B 65 25.704 -19.350 -5.933 1.00 0.00 O ATOM 2591 CB GLU B 65 27.042 -18.973 -3.265 1.00 0.00 C ATOM 2592 CG GLU B 65 27.655 -20.290 -2.851 1.00 0.00 C ATOM 2593 CD GLU B 65 29.053 -20.129 -2.277 1.00 0.00 C ATOM 2594 OE1 GLU B 65 29.434 -18.993 -1.939 1.00 0.00 O ATOM 2595 OE2 GLU B 65 29.763 -21.157 -2.161 1.00 0.00 O ATOM 0 H GLU B 65 25.281 -19.886 -1.719 1.00 0.00 H new ATOM 0 HA GLU B 65 25.248 -17.977 -3.807 1.00 0.00 H new ATOM 0 HB2 GLU B 65 27.579 -18.604 -4.139 1.00 0.00 H new ATOM 0 HB3 GLU B 65 27.204 -18.252 -2.464 1.00 0.00 H new ATOM 0 HG2 GLU B 65 27.015 -20.768 -2.109 1.00 0.00 H new ATOM 0 HG3 GLU B 65 27.695 -20.955 -3.714 1.00 0.00 H new ATOM 2602 N LYS B 66 24.533 -20.881 -4.784 1.00 0.00 N ATOM 2603 CA LYS B 66 24.239 -21.669 -5.987 1.00 0.00 C ATOM 2604 C LYS B 66 22.756 -21.657 -6.320 1.00 0.00 C ATOM 2605 O LYS B 66 22.268 -22.489 -7.098 1.00 0.00 O ATOM 2606 CB LYS B 66 24.738 -23.104 -5.822 1.00 0.00 C ATOM 2607 CG LYS B 66 26.195 -23.208 -5.396 1.00 0.00 C ATOM 2608 CD LYS B 66 27.134 -22.705 -6.481 1.00 0.00 C ATOM 2609 CE LYS B 66 28.163 -23.776 -6.842 1.00 0.00 C ATOM 2610 NZ LYS B 66 27.481 -25.077 -7.156 1.00 0.00 N ATOM 0 H LYS B 66 24.128 -21.248 -3.923 1.00 0.00 H new ATOM 0 HA LYS B 66 24.767 -21.205 -6.820 1.00 0.00 H new ATOM 0 HB2 LYS B 66 24.117 -23.611 -5.083 1.00 0.00 H new ATOM 0 HB3 LYS B 66 24.607 -23.634 -6.766 1.00 0.00 H new ATOM 0 HG2 LYS B 66 26.350 -22.631 -4.484 1.00 0.00 H new ATOM 0 HG3 LYS B 66 26.433 -24.246 -5.161 1.00 0.00 H new ATOM 0 HD2 LYS B 66 26.561 -22.431 -7.367 1.00 0.00 H new ATOM 0 HD3 LYS B 66 27.644 -21.804 -6.139 1.00 0.00 H new ATOM 0 HE2 LYS B 66 28.750 -23.450 -7.701 1.00 0.00 H new ATOM 0 HE3 LYS B 66 28.859 -23.914 -6.014 1.00 0.00 H new ATOM 0 HZ1 LYS B 66 27.983 -25.553 -7.932 1.00 0.00 H new ATOM 0 HZ2 LYS B 66 27.490 -25.686 -6.313 1.00 0.00 H new ATOM 0 HZ3 LYS B 66 26.498 -24.894 -7.440 1.00 0.00 H new ATOM 2624 N LEU B 67 22.019 -20.756 -5.678 1.00 0.00 N ATOM 2625 CA LEU B 67 20.585 -20.635 -5.970 1.00 0.00 C ATOM 2626 C LEU B 67 20.391 -19.962 -7.323 1.00 0.00 C ATOM 2627 O LEU B 67 21.296 -19.278 -7.823 1.00 0.00 O ATOM 2628 CB LEU B 67 19.898 -19.823 -4.859 1.00 0.00 C ATOM 2629 CG LEU B 67 19.921 -20.493 -3.465 1.00 0.00 C ATOM 2630 CD1 LEU B 67 19.252 -19.593 -2.441 1.00 0.00 C ATOM 2631 CD2 LEU B 67 19.202 -21.840 -3.524 1.00 0.00 C ATOM 0 H LEU B 67 22.373 -20.113 -4.970 1.00 0.00 H new ATOM 0 HA LEU B 67 20.135 -21.627 -6.007 1.00 0.00 H new ATOM 0 HB2 LEU B 67 20.381 -18.848 -4.787 1.00 0.00 H new ATOM 0 HB3 LEU B 67 18.861 -19.645 -5.145 1.00 0.00 H new ATOM 0 HG LEU B 67 20.957 -20.654 -3.168 1.00 0.00 H new ATOM 0 HD11 LEU B 67 19.274 -20.075 -1.464 1.00 0.00 H new ATOM 0 HD12 LEU B 67 19.784 -18.643 -2.389 1.00 0.00 H new ATOM 0 HD13 LEU B 67 18.217 -19.414 -2.734 1.00 0.00 H new ATOM 0 HD21 LEU B 67 19.222 -22.306 -2.539 1.00 0.00 H new ATOM 0 HD22 LEU B 67 18.168 -21.687 -3.832 1.00 0.00 H new ATOM 0 HD23 LEU B 67 19.703 -22.489 -4.243 1.00 0.00 H new ATOM 2643 N GLU B 68 19.238 -20.179 -7.930 1.00 0.00 N ATOM 2644 CA GLU B 68 18.923 -19.549 -9.219 1.00 0.00 C ATOM 2645 C GLU B 68 18.995 -18.033 -9.097 1.00 0.00 C ATOM 2646 O GLU B 68 18.591 -17.460 -8.073 1.00 0.00 O ATOM 2647 CB GLU B 68 17.459 -19.948 -9.567 1.00 0.00 C ATOM 2648 CG GLU B 68 16.555 -19.603 -8.372 1.00 0.00 C ATOM 2649 CD GLU B 68 16.164 -20.822 -7.573 1.00 0.00 C ATOM 2650 OE1 GLU B 68 16.987 -21.408 -6.838 1.00 0.00 O ATOM 2651 OE2 GLU B 68 14.953 -21.170 -7.685 1.00 0.00 O ATOM 0 H GLU B 68 18.502 -20.781 -7.561 1.00 0.00 H new ATOM 0 HA GLU B 68 19.630 -19.872 -9.983 1.00 0.00 H new ATOM 0 HB2 GLU B 68 17.125 -19.418 -10.459 1.00 0.00 H new ATOM 0 HB3 GLU B 68 17.401 -21.013 -9.789 1.00 0.00 H new ATOM 0 HG2 GLU B 68 17.071 -18.897 -7.722 1.00 0.00 H new ATOM 0 HG3 GLU B 68 15.655 -19.105 -8.733 1.00 0.00 H new ATOM 2658 N ALA B 69 19.499 -17.373 -10.124 1.00 0.00 N ATOM 2659 CA ALA B 69 19.647 -15.925 -10.133 1.00 0.00 C ATOM 2660 C ALA B 69 18.353 -15.248 -9.682 1.00 0.00 C ATOM 2661 O ALA B 69 17.286 -15.547 -10.232 1.00 0.00 O ATOM 2662 CB ALA B 69 19.988 -15.445 -11.550 1.00 0.00 C ATOM 0 H ALA B 69 19.819 -17.826 -10.980 1.00 0.00 H new ATOM 0 HA ALA B 69 20.450 -15.661 -9.445 1.00 0.00 H new ATOM 0 HB1 ALA B 69 20.097 -14.361 -11.550 1.00 0.00 H new ATOM 0 HB2 ALA B 69 20.922 -15.904 -11.875 1.00 0.00 H new ATOM 0 HB3 ALA B 69 19.187 -15.729 -12.233 1.00 0.00 H new ATOM 2668 N ILE B 70 18.471 -14.249 -8.816 1.00 0.00 N ATOM 2669 CA ILE B 70 17.272 -13.573 -8.315 1.00 0.00 C ATOM 2670 C ILE B 70 16.672 -12.680 -9.402 1.00 0.00 C ATOM 2671 O ILE B 70 17.406 -11.971 -10.092 1.00 0.00 O ATOM 2672 CB ILE B 70 17.549 -12.759 -7.053 1.00 0.00 C ATOM 2673 CG1 ILE B 70 16.251 -12.152 -6.499 1.00 0.00 C ATOM 2674 CG2 ILE B 70 18.574 -11.666 -7.291 1.00 0.00 C ATOM 2675 CD1 ILE B 70 16.336 -11.840 -5.008 1.00 0.00 C ATOM 0 H ILE B 70 19.355 -13.894 -8.452 1.00 0.00 H new ATOM 0 HA ILE B 70 16.554 -14.348 -8.047 1.00 0.00 H new ATOM 0 HB ILE B 70 17.964 -13.448 -6.317 1.00 0.00 H new ATOM 0 HG12 ILE B 70 16.021 -11.237 -7.045 1.00 0.00 H new ATOM 0 HG13 ILE B 70 15.427 -12.844 -6.675 1.00 0.00 H new ATOM 0 HG21 ILE B 70 18.739 -11.114 -6.366 1.00 0.00 H new ATOM 0 HG22 ILE B 70 19.513 -12.113 -7.619 1.00 0.00 H new ATOM 0 HG23 ILE B 70 18.208 -10.985 -8.060 1.00 0.00 H new ATOM 0 HD11 ILE B 70 15.391 -11.413 -4.671 1.00 0.00 H new ATOM 0 HD12 ILE B 70 16.538 -12.758 -4.455 1.00 0.00 H new ATOM 0 HD13 ILE B 70 17.140 -11.126 -4.831 1.00 0.00 H new ATOM 2687 N THR B 71 15.356 -12.699 -9.516 1.00 0.00 N ATOM 2688 CA THR B 71 14.680 -11.827 -10.490 1.00 0.00 C ATOM 2689 C THR B 71 14.391 -10.469 -9.849 1.00 0.00 C ATOM 2690 O THR B 71 14.275 -10.348 -8.631 1.00 0.00 O ATOM 2691 CB THR B 71 13.351 -12.420 -10.967 1.00 0.00 C ATOM 2692 OG1 THR B 71 12.482 -12.576 -9.825 1.00 0.00 O ATOM 2693 CG2 THR B 71 13.524 -13.746 -11.661 1.00 0.00 C ATOM 0 H THR B 71 14.735 -13.291 -8.964 1.00 0.00 H new ATOM 0 HA THR B 71 15.346 -11.725 -11.347 1.00 0.00 H new ATOM 0 HB THR B 71 12.918 -11.736 -11.697 1.00 0.00 H new ATOM 0 HG1 THR B 71 11.625 -12.954 -10.115 1.00 0.00 H new ATOM 0 HG21 THR B 71 12.551 -14.120 -11.978 1.00 0.00 H new ATOM 0 HG22 THR B 71 14.166 -13.619 -12.533 1.00 0.00 H new ATOM 0 HG23 THR B 71 13.981 -14.459 -10.975 1.00 0.00 H new ATOM 2701 N ASP B 72 14.139 -9.475 -10.706 1.00 0.00 N ATOM 2702 CA ASP B 72 13.827 -8.132 -10.206 1.00 0.00 C ATOM 2703 C ASP B 72 12.541 -8.161 -9.388 1.00 0.00 C ATOM 2704 O ASP B 72 12.392 -7.397 -8.420 1.00 0.00 O ATOM 2705 CB ASP B 72 13.683 -7.168 -11.390 1.00 0.00 C ATOM 2706 CG ASP B 72 15.015 -6.666 -11.914 1.00 0.00 C ATOM 2707 OD1 ASP B 72 16.066 -6.910 -11.284 1.00 0.00 O ATOM 2708 OD2 ASP B 72 15.004 -5.984 -12.967 1.00 0.00 O ATOM 0 H ASP B 72 14.144 -9.569 -11.722 1.00 0.00 H new ATOM 0 HA ASP B 72 14.637 -7.790 -9.562 1.00 0.00 H new ATOM 0 HB2 ASP B 72 13.148 -7.670 -12.196 1.00 0.00 H new ATOM 0 HB3 ASP B 72 13.075 -6.316 -11.085 1.00 0.00 H new ATOM 2713 N GLU B 73 11.577 -8.976 -9.808 1.00 0.00 N ATOM 2714 CA GLU B 73 10.306 -9.044 -9.102 1.00 0.00 C ATOM 2715 C GLU B 73 10.506 -9.528 -7.672 1.00 0.00 C ATOM 2716 O GLU B 73 10.009 -8.913 -6.717 1.00 0.00 O ATOM 2717 CB GLU B 73 9.280 -9.917 -9.827 1.00 0.00 C ATOM 2718 CG GLU B 73 7.890 -9.800 -9.234 1.00 0.00 C ATOM 2719 CD GLU B 73 6.782 -10.435 -10.021 1.00 0.00 C ATOM 2720 OE1 GLU B 73 7.029 -11.331 -10.860 1.00 0.00 O ATOM 2721 OE2 GLU B 73 5.604 -10.050 -9.782 1.00 0.00 O ATOM 0 H GLU B 73 11.651 -9.588 -10.620 1.00 0.00 H new ATOM 0 HA GLU B 73 9.904 -8.031 -9.078 1.00 0.00 H new ATOM 0 HB2 GLU B 73 9.247 -9.634 -10.879 1.00 0.00 H new ATOM 0 HB3 GLU B 73 9.601 -10.958 -9.787 1.00 0.00 H new ATOM 0 HG2 GLU B 73 7.903 -10.245 -8.239 1.00 0.00 H new ATOM 0 HG3 GLU B 73 7.659 -8.742 -9.107 1.00 0.00 H new ATOM 2728 N GLU B 74 11.310 -10.592 -7.518 1.00 0.00 N ATOM 2729 CA GLU B 74 11.583 -11.087 -6.165 1.00 0.00 C ATOM 2730 C GLU B 74 12.305 -10.032 -5.343 1.00 0.00 C ATOM 2731 O GLU B 74 11.907 -9.722 -4.224 1.00 0.00 O ATOM 2732 CB GLU B 74 12.390 -12.385 -6.190 1.00 0.00 C ATOM 2733 CG GLU B 74 12.676 -12.901 -4.784 1.00 0.00 C ATOM 2734 CD GLU B 74 13.518 -14.142 -4.732 1.00 0.00 C ATOM 2735 OE1 GLU B 74 13.678 -14.858 -5.736 1.00 0.00 O ATOM 2736 OE2 GLU B 74 14.060 -14.443 -3.635 1.00 0.00 O ATOM 0 H GLU B 74 11.762 -11.104 -8.275 1.00 0.00 H new ATOM 0 HA GLU B 74 10.622 -11.302 -5.697 1.00 0.00 H new ATOM 0 HB2 GLU B 74 11.843 -13.143 -6.751 1.00 0.00 H new ATOM 0 HB3 GLU B 74 13.331 -12.218 -6.714 1.00 0.00 H new ATOM 0 HG2 GLU B 74 13.176 -12.115 -4.218 1.00 0.00 H new ATOM 0 HG3 GLU B 74 11.728 -13.100 -4.285 1.00 0.00 H new ATOM 2743 N ASN B 75 13.323 -9.407 -5.922 1.00 0.00 N ATOM 2744 CA ASN B 75 14.103 -8.389 -5.257 1.00 0.00 C ATOM 2745 C ASN B 75 13.289 -7.235 -4.724 1.00 0.00 C ATOM 2746 O ASN B 75 13.545 -6.757 -3.604 1.00 0.00 O ATOM 2747 CB ASN B 75 15.221 -7.893 -6.183 1.00 0.00 C ATOM 2748 CG ASN B 75 16.397 -7.326 -5.424 1.00 0.00 C ATOM 2749 OD1 ASN B 75 16.929 -7.952 -4.506 1.00 0.00 O ATOM 2750 ND2 ASN B 75 16.816 -6.120 -5.806 1.00 0.00 N ATOM 0 H ASN B 75 13.628 -9.600 -6.876 1.00 0.00 H new ATOM 0 HA ASN B 75 14.537 -8.863 -4.377 1.00 0.00 H new ATOM 0 HB2 ASN B 75 15.561 -8.718 -6.809 1.00 0.00 H new ATOM 0 HB3 ASN B 75 14.822 -7.129 -6.851 1.00 0.00 H new ATOM 0 HD21 ASN B 75 17.606 -5.681 -5.333 1.00 0.00 H new ATOM 0 HD22 ASN B 75 16.347 -5.636 -6.571 1.00 0.00 H new ATOM 2757 N ASP B 76 12.273 -6.782 -5.455 1.00 0.00 N ATOM 2758 CA ASP B 76 11.442 -5.668 -5.025 1.00 0.00 C ATOM 2759 C ASP B 76 10.647 -6.026 -3.767 1.00 0.00 C ATOM 2760 O ASP B 76 10.408 -5.185 -2.911 1.00 0.00 O ATOM 2761 CB ASP B 76 10.436 -5.277 -6.117 1.00 0.00 C ATOM 2762 CG ASP B 76 11.035 -4.555 -7.289 1.00 0.00 C ATOM 2763 OD1 ASP B 76 12.187 -4.073 -7.203 1.00 0.00 O ATOM 2764 OD2 ASP B 76 10.348 -4.474 -8.340 1.00 0.00 O ATOM 0 H ASP B 76 12.006 -7.177 -6.357 1.00 0.00 H new ATOM 0 HA ASP B 76 12.116 -4.836 -4.819 1.00 0.00 H new ATOM 0 HB2 ASP B 76 9.941 -6.179 -6.477 1.00 0.00 H new ATOM 0 HB3 ASP B 76 9.665 -4.646 -5.674 1.00 0.00 H new ATOM 2769 N MET B 77 10.177 -7.272 -3.722 1.00 0.00 N ATOM 2770 CA MET B 77 9.414 -7.750 -2.565 1.00 0.00 C ATOM 2771 C MET B 77 10.370 -8.036 -1.407 1.00 0.00 C ATOM 2772 O MET B 77 10.130 -7.680 -0.275 1.00 0.00 O ATOM 2773 CB MET B 77 8.661 -9.018 -2.935 1.00 0.00 C ATOM 2774 CG MET B 77 7.288 -9.203 -2.436 1.00 0.00 C ATOM 2775 SD MET B 77 6.292 -7.746 -2.189 1.00 0.00 S ATOM 2776 CE MET B 77 6.694 -7.293 -0.524 1.00 0.00 C ATOM 0 H MET B 77 10.307 -7.962 -4.462 1.00 0.00 H new ATOM 0 HA MET B 77 8.698 -6.985 -2.263 1.00 0.00 H new ATOM 0 HB2 MET B 77 8.626 -9.075 -4.023 1.00 0.00 H new ATOM 0 HB3 MET B 77 9.254 -9.865 -2.590 1.00 0.00 H new ATOM 0 HG2 MET B 77 6.762 -9.854 -3.135 1.00 0.00 H new ATOM 0 HG3 MET B 77 7.345 -9.735 -1.486 1.00 0.00 H new ATOM 0 HE1 MET B 77 5.783 -7.254 0.073 1.00 0.00 H new ATOM 0 HE2 MET B 77 7.374 -8.032 -0.100 1.00 0.00 H new ATOM 0 HE3 MET B 77 7.173 -6.314 -0.519 1.00 0.00 H new ATOM 2786 N LEU B 78 11.519 -8.623 -1.769 1.00 0.00 N ATOM 2787 CA LEU B 78 12.514 -8.989 -0.749 1.00 0.00 C ATOM 2788 C LEU B 78 13.054 -7.770 -0.036 1.00 0.00 C ATOM 2789 O LEU B 78 13.226 -7.772 1.193 1.00 0.00 O ATOM 2790 CB LEU B 78 13.627 -9.815 -1.378 1.00 0.00 C ATOM 2791 CG LEU B 78 14.696 -10.367 -0.424 1.00 0.00 C ATOM 2792 CD1 LEU B 78 14.065 -11.421 0.482 1.00 0.00 C ATOM 2793 CD2 LEU B 78 15.850 -10.957 -1.227 1.00 0.00 C ATOM 0 H LEU B 78 11.779 -8.849 -2.729 1.00 0.00 H new ATOM 0 HA LEU B 78 12.023 -9.600 0.008 1.00 0.00 H new ATOM 0 HB2 LEU B 78 13.173 -10.655 -1.903 1.00 0.00 H new ATOM 0 HB3 LEU B 78 14.125 -9.201 -2.129 1.00 0.00 H new ATOM 0 HG LEU B 78 15.091 -9.563 0.197 1.00 0.00 H new ATOM 0 HD11 LEU B 78 14.820 -11.816 1.161 1.00 0.00 H new ATOM 0 HD12 LEU B 78 13.259 -10.969 1.059 1.00 0.00 H new ATOM 0 HD13 LEU B 78 13.665 -12.232 -0.127 1.00 0.00 H new ATOM 0 HD21 LEU B 78 16.606 -11.347 -0.545 1.00 0.00 H new ATOM 0 HD22 LEU B 78 15.479 -11.765 -1.858 1.00 0.00 H new ATOM 0 HD23 LEU B 78 16.292 -10.182 -1.853 1.00 0.00 H new ATOM 2805 N ASP B 79 13.182 -6.663 -0.759 1.00 0.00 N ATOM 2806 CA ASP B 79 13.628 -5.392 -0.229 1.00 0.00 C ATOM 2807 C ASP B 79 12.844 -4.940 0.994 1.00 0.00 C ATOM 2808 O ASP B 79 13.370 -4.216 1.839 1.00 0.00 O ATOM 2809 CB ASP B 79 13.539 -4.314 -1.318 1.00 0.00 C ATOM 2810 CG ASP B 79 14.667 -4.350 -2.319 1.00 0.00 C ATOM 2811 OD1 ASP B 79 15.600 -5.172 -2.180 1.00 0.00 O ATOM 2812 OD2 ASP B 79 14.622 -3.539 -3.282 1.00 0.00 O ATOM 0 H ASP B 79 12.971 -6.630 -1.756 1.00 0.00 H new ATOM 0 HA ASP B 79 14.661 -5.534 0.089 1.00 0.00 H new ATOM 0 HB2 ASP B 79 12.594 -4.427 -1.849 1.00 0.00 H new ATOM 0 HB3 ASP B 79 13.522 -3.334 -0.842 1.00 0.00 H new ATOM 2817 N CYS B 80 11.559 -5.304 1.066 1.00 0.00 N ATOM 2818 CA CYS B 80 10.688 -4.922 2.138 1.00 0.00 C ATOM 2819 C CYS B 80 10.657 -5.891 3.314 1.00 0.00 C ATOM 2820 O CYS B 80 9.967 -5.615 4.305 1.00 0.00 O ATOM 2821 CB CYS B 80 9.285 -4.728 1.514 1.00 0.00 C ATOM 2822 SG CYS B 80 8.071 -5.902 2.199 1.00 0.00 S ATOM 0 H CYS B 80 11.105 -5.883 0.359 1.00 0.00 H new ATOM 0 HA CYS B 80 11.065 -4.003 2.587 1.00 0.00 H new ATOM 0 HB2 CYS B 80 8.945 -3.708 1.693 1.00 0.00 H new ATOM 0 HB3 CYS B 80 9.347 -4.858 0.434 1.00 0.00 H new ATOM 2827 N ALA B 81 11.341 -7.021 3.236 1.00 0.00 N ATOM 2828 CA ALA B 81 11.282 -8.010 4.311 1.00 0.00 C ATOM 2829 C ALA B 81 11.941 -7.504 5.588 1.00 0.00 C ATOM 2830 O ALA B 81 12.914 -6.752 5.544 1.00 0.00 O ATOM 2831 CB ALA B 81 11.971 -9.302 3.881 1.00 0.00 C ATOM 0 H ALA B 81 11.939 -7.279 2.451 1.00 0.00 H new ATOM 0 HA ALA B 81 10.227 -8.195 4.515 1.00 0.00 H new ATOM 0 HB1 ALA B 81 11.919 -10.029 4.691 1.00 0.00 H new ATOM 0 HB2 ALA B 81 11.472 -9.705 3.000 1.00 0.00 H new ATOM 0 HB3 ALA B 81 13.015 -9.096 3.644 1.00 0.00 H new ATOM 2837 N TYR B 82 11.466 -7.997 6.717 1.00 0.00 N ATOM 2838 CA TYR B 82 12.096 -7.756 8.009 1.00 0.00 C ATOM 2839 C TYR B 82 13.296 -8.695 8.166 1.00 0.00 C ATOM 2840 O TYR B 82 13.221 -9.846 7.732 1.00 0.00 O ATOM 2841 CB TYR B 82 11.067 -8.084 9.127 1.00 0.00 C ATOM 2842 CG TYR B 82 11.676 -8.094 10.507 1.00 0.00 C ATOM 2843 CD1 TYR B 82 11.809 -6.913 11.234 1.00 0.00 C ATOM 2844 CD2 TYR B 82 12.151 -9.271 11.079 1.00 0.00 C ATOM 2845 CE1 TYR B 82 12.384 -6.913 12.493 1.00 0.00 C ATOM 2846 CE2 TYR B 82 12.730 -9.278 12.336 1.00 0.00 C ATOM 2847 CZ TYR B 82 12.828 -8.096 13.041 1.00 0.00 C ATOM 2848 OH TYR B 82 13.396 -8.089 14.298 1.00 0.00 O ATOM 0 H TYR B 82 10.629 -8.578 6.767 1.00 0.00 H new ATOM 0 HA TYR B 82 12.422 -6.718 8.077 1.00 0.00 H new ATOM 0 HB2 TYR B 82 10.261 -7.351 9.097 1.00 0.00 H new ATOM 0 HB3 TYR B 82 10.620 -9.058 8.927 1.00 0.00 H new ATOM 0 HD1 TYR B 82 11.458 -5.984 10.809 1.00 0.00 H new ATOM 0 HD2 TYR B 82 12.066 -10.198 10.531 1.00 0.00 H new ATOM 0 HE1 TYR B 82 12.484 -5.989 13.043 1.00 0.00 H new ATOM 0 HE2 TYR B 82 13.101 -10.199 12.761 1.00 0.00 H new ATOM 0 HH TYR B 82 13.657 -9.001 14.544 1.00 0.00 H new ATOM 2858 N GLY B 83 14.339 -8.261 8.844 1.00 0.00 N ATOM 2859 CA GLY B 83 15.468 -9.112 9.178 1.00 0.00 C ATOM 2860 C GLY B 83 16.235 -9.632 7.983 1.00 0.00 C ATOM 2861 O GLY B 83 16.754 -10.773 8.024 1.00 0.00 O ATOM 0 H GLY B 83 14.430 -7.303 9.182 1.00 0.00 H new ATOM 0 HA2 GLY B 83 16.151 -8.553 9.818 1.00 0.00 H new ATOM 0 HA3 GLY B 83 15.108 -9.960 9.760 1.00 0.00 H new ATOM 2865 N LEU B 84 16.394 -8.853 6.944 1.00 0.00 N ATOM 2866 CA LEU B 84 17.141 -9.181 5.760 1.00 0.00 C ATOM 2867 C LEU B 84 18.612 -9.466 6.069 1.00 0.00 C ATOM 2868 O LEU B 84 19.220 -8.824 6.935 1.00 0.00 O ATOM 2869 CB LEU B 84 17.092 -8.018 4.758 1.00 0.00 C ATOM 2870 CG LEU B 84 15.991 -7.995 3.726 1.00 0.00 C ATOM 2871 CD1 LEU B 84 16.124 -6.734 2.848 1.00 0.00 C ATOM 2872 CD2 LEU B 84 16.044 -9.229 2.821 1.00 0.00 C ATOM 0 H LEU B 84 15.982 -7.921 6.901 1.00 0.00 H new ATOM 0 HA LEU B 84 16.681 -10.077 5.342 1.00 0.00 H new ATOM 0 HB2 LEU B 84 17.028 -7.092 5.330 1.00 0.00 H new ATOM 0 HB3 LEU B 84 18.043 -8.000 4.226 1.00 0.00 H new ATOM 0 HG LEU B 84 15.040 -7.991 4.259 1.00 0.00 H new ATOM 0 HD11 LEU B 84 15.327 -6.722 2.105 1.00 0.00 H new ATOM 0 HD12 LEU B 84 16.049 -5.845 3.474 1.00 0.00 H new ATOM 0 HD13 LEU B 84 17.090 -6.742 2.344 1.00 0.00 H new ATOM 0 HD21 LEU B 84 15.237 -9.179 2.090 1.00 0.00 H new ATOM 0 HD22 LEU B 84 17.002 -9.259 2.302 1.00 0.00 H new ATOM 0 HD23 LEU B 84 15.931 -10.129 3.426 1.00 0.00 H new ATOM 2884 N THR B 85 19.162 -10.479 5.437 1.00 0.00 N ATOM 2885 CA THR B 85 20.568 -10.822 5.579 1.00 0.00 C ATOM 2886 C THR B 85 21.172 -10.916 4.162 1.00 0.00 C ATOM 2887 O THR B 85 20.435 -10.842 3.187 1.00 0.00 O ATOM 2888 CB THR B 85 20.775 -12.222 6.225 1.00 0.00 C ATOM 2889 OG1 THR B 85 20.291 -13.207 5.304 1.00 0.00 O ATOM 2890 CG2 THR B 85 20.036 -12.344 7.538 1.00 0.00 C ATOM 0 H THR B 85 18.648 -11.094 4.806 1.00 0.00 H new ATOM 0 HA THR B 85 21.032 -10.062 6.208 1.00 0.00 H new ATOM 0 HB THR B 85 21.835 -12.367 6.434 1.00 0.00 H new ATOM 0 HG1 THR B 85 19.398 -12.951 4.991 1.00 0.00 H new ATOM 0 HG21 THR B 85 20.204 -13.335 7.959 1.00 0.00 H new ATOM 0 HG22 THR B 85 20.401 -11.588 8.233 1.00 0.00 H new ATOM 0 HG23 THR B 85 18.969 -12.197 7.370 1.00 0.00 H new ATOM 2898 N ASP B 86 22.464 -11.177 4.103 1.00 0.00 N ATOM 2899 CA ASP B 86 23.150 -11.383 2.836 1.00 0.00 C ATOM 2900 C ASP B 86 22.842 -12.761 2.246 1.00 0.00 C ATOM 2901 O ASP B 86 23.285 -13.072 1.139 1.00 0.00 O ATOM 2902 CB ASP B 86 24.672 -11.276 3.042 1.00 0.00 C ATOM 2903 CG ASP B 86 25.137 -9.855 3.258 1.00 0.00 C ATOM 2904 OD1 ASP B 86 24.318 -8.920 3.108 1.00 0.00 O ATOM 2905 OD2 ASP B 86 26.339 -9.676 3.563 1.00 0.00 O ATOM 0 H ASP B 86 23.066 -11.252 4.923 1.00 0.00 H new ATOM 0 HA ASP B 86 22.798 -10.615 2.147 1.00 0.00 H new ATOM 0 HB2 ASP B 86 24.961 -11.882 3.901 1.00 0.00 H new ATOM 0 HB3 ASP B 86 25.181 -11.692 2.173 1.00 0.00 H new ATOM 2910 N ARG B 87 22.109 -13.582 2.982 1.00 0.00 N ATOM 2911 CA ARG B 87 21.760 -14.926 2.492 1.00 0.00 C ATOM 2912 C ARG B 87 20.248 -15.112 2.437 1.00 0.00 C ATOM 2913 O ARG B 87 19.758 -16.237 2.561 1.00 0.00 O ATOM 2914 CB ARG B 87 22.392 -15.977 3.418 1.00 0.00 C ATOM 2915 CG ARG B 87 23.924 -16.005 3.328 1.00 0.00 C ATOM 2916 CD ARG B 87 24.517 -16.639 4.594 1.00 0.00 C ATOM 2917 NE ARG B 87 24.289 -15.777 5.756 1.00 0.00 N ATOM 2918 CZ ARG B 87 23.572 -16.146 6.810 1.00 0.00 C ATOM 2919 NH1 ARG B 87 23.015 -17.346 6.858 1.00 0.00 N ATOM 2920 NH2 ARG B 87 23.405 -15.311 7.827 1.00 0.00 N ATOM 0 H ARG B 87 21.745 -13.356 3.907 1.00 0.00 H new ATOM 0 HA ARG B 87 22.147 -15.046 1.480 1.00 0.00 H new ATOM 0 HB2 ARG B 87 22.097 -15.772 4.447 1.00 0.00 H new ATOM 0 HB3 ARG B 87 22.000 -16.962 3.164 1.00 0.00 H new ATOM 0 HG2 ARG B 87 24.234 -16.571 2.449 1.00 0.00 H new ATOM 0 HG3 ARG B 87 24.307 -14.992 3.206 1.00 0.00 H new ATOM 0 HD2 ARG B 87 24.065 -17.616 4.764 1.00 0.00 H new ATOM 0 HD3 ARG B 87 25.586 -16.802 4.459 1.00 0.00 H new ATOM 0 HE ARG B 87 24.703 -14.845 5.755 1.00 0.00 H new ATOM 0 HH11 ARG B 87 23.135 -17.996 6.081 1.00 0.00 H new ATOM 0 HH12 ARG B 87 22.466 -17.621 7.672 1.00 0.00 H new ATOM 0 HH21 ARG B 87 23.828 -14.383 7.800 1.00 0.00 H new ATOM 0 HH22 ARG B 87 22.854 -15.597 8.636 1.00 0.00 H new ATOM 2934 N SER B 88 19.513 -14.033 2.196 1.00 0.00 N ATOM 2935 CA SER B 88 18.062 -14.043 2.214 1.00 0.00 C ATOM 2936 C SER B 88 17.442 -14.230 0.837 1.00 0.00 C ATOM 2937 O SER B 88 17.888 -13.600 -0.138 1.00 0.00 O ATOM 2938 CB SER B 88 17.558 -12.685 2.774 1.00 0.00 C ATOM 2939 OG SER B 88 17.847 -12.568 4.166 1.00 0.00 O ATOM 0 H SER B 88 19.914 -13.120 1.981 1.00 0.00 H new ATOM 0 HA SER B 88 17.763 -14.888 2.834 1.00 0.00 H new ATOM 0 HB2 SER B 88 18.029 -11.866 2.231 1.00 0.00 H new ATOM 0 HB3 SER B 88 16.483 -12.597 2.613 1.00 0.00 H new ATOM 0 HG SER B 88 17.038 -12.760 4.685 1.00 0.00 H new ATOM 2945 N ARG B 89 16.386 -15.026 0.737 1.00 0.00 N ATOM 2946 CA ARG B 89 15.605 -15.170 -0.481 1.00 0.00 C ATOM 2947 C ARG B 89 14.126 -15.356 -0.085 1.00 0.00 C ATOM 2948 O ARG B 89 13.832 -15.713 1.063 1.00 0.00 O ATOM 2949 CB ARG B 89 15.996 -16.367 -1.345 1.00 0.00 C ATOM 2950 CG ARG B 89 17.335 -16.349 -2.024 1.00 0.00 C ATOM 2951 CD ARG B 89 17.500 -15.194 -2.988 1.00 0.00 C ATOM 2952 NE ARG B 89 16.643 -15.383 -4.177 1.00 0.00 N ATOM 2953 CZ ARG B 89 17.031 -16.106 -5.237 1.00 0.00 C ATOM 2954 NH1 ARG B 89 18.237 -16.642 -5.272 1.00 0.00 N ATOM 2955 NH2 ARG B 89 16.212 -16.221 -6.279 1.00 0.00 N ATOM 0 H ARG B 89 16.044 -15.597 1.510 1.00 0.00 H new ATOM 0 HA ARG B 89 15.790 -14.272 -1.070 1.00 0.00 H new ATOM 0 HB2 ARG B 89 15.954 -17.257 -0.718 1.00 0.00 H new ATOM 0 HB3 ARG B 89 15.234 -16.483 -2.116 1.00 0.00 H new ATOM 0 HG2 ARG B 89 18.118 -16.297 -1.267 1.00 0.00 H new ATOM 0 HG3 ARG B 89 17.474 -17.286 -2.563 1.00 0.00 H new ATOM 0 HD2 ARG B 89 17.241 -14.259 -2.491 1.00 0.00 H new ATOM 0 HD3 ARG B 89 18.543 -15.115 -3.294 1.00 0.00 H new ATOM 0 HE ARG B 89 15.721 -14.947 -4.192 1.00 0.00 H new ATOM 0 HH11 ARG B 89 18.878 -16.507 -4.490 1.00 0.00 H new ATOM 0 HH12 ARG B 89 18.528 -17.191 -6.081 1.00 0.00 H new ATOM 0 HH21 ARG B 89 15.301 -15.762 -6.265 1.00 0.00 H new ATOM 0 HH22 ARG B 89 16.495 -16.768 -7.092 1.00 0.00 H new ATOM 2969 N LEU B 90 13.225 -15.129 -1.038 1.00 0.00 N ATOM 2970 CA LEU B 90 11.820 -15.472 -0.793 1.00 0.00 C ATOM 2971 C LEU B 90 11.625 -16.954 -1.085 1.00 0.00 C ATOM 2972 O LEU B 90 11.837 -17.419 -2.218 1.00 0.00 O ATOM 2973 CB LEU B 90 10.878 -14.599 -1.594 1.00 0.00 C ATOM 2974 CG LEU B 90 10.974 -13.089 -1.352 1.00 0.00 C ATOM 2975 CD1 LEU B 90 9.967 -12.350 -2.230 1.00 0.00 C ATOM 2976 CD2 LEU B 90 10.737 -12.747 0.118 1.00 0.00 C ATOM 0 H LEU B 90 13.426 -14.726 -1.953 1.00 0.00 H new ATOM 0 HA LEU B 90 11.576 -15.281 0.252 1.00 0.00 H new ATOM 0 HB2 LEU B 90 11.056 -14.787 -2.653 1.00 0.00 H new ATOM 0 HB3 LEU B 90 9.857 -14.914 -1.381 1.00 0.00 H new ATOM 0 HG LEU B 90 11.982 -12.770 -1.615 1.00 0.00 H new ATOM 0 HD11 LEU B 90 10.045 -11.278 -2.049 1.00 0.00 H new ATOM 0 HD12 LEU B 90 10.178 -12.557 -3.279 1.00 0.00 H new ATOM 0 HD13 LEU B 90 8.959 -12.686 -1.989 1.00 0.00 H new ATOM 0 HD21 LEU B 90 10.812 -11.669 0.257 1.00 0.00 H new ATOM 0 HD22 LEU B 90 9.743 -13.083 0.414 1.00 0.00 H new ATOM 0 HD23 LEU B 90 11.487 -13.245 0.733 1.00 0.00 H new ATOM 2988 N GLY B 91 11.255 -17.720 -0.061 1.00 0.00 N ATOM 2989 CA GLY B 91 11.163 -19.154 -0.183 1.00 0.00 C ATOM 2990 C GLY B 91 10.259 -19.663 -1.258 1.00 0.00 C ATOM 2991 O GLY B 91 10.441 -20.803 -1.746 1.00 0.00 O ATOM 0 H GLY B 91 11.015 -17.359 0.862 1.00 0.00 H new ATOM 0 HA2 GLY B 91 12.164 -19.549 -0.360 1.00 0.00 H new ATOM 0 HA3 GLY B 91 10.825 -19.559 0.771 1.00 0.00 H new ATOM 2995 N CYS B 92 9.167 -18.943 -1.603 1.00 0.00 N ATOM 2996 CA CYS B 92 8.259 -19.446 -2.625 1.00 0.00 C ATOM 2997 C CYS B 92 8.912 -19.488 -3.998 1.00 0.00 C ATOM 2998 O CYS B 92 8.369 -20.157 -4.900 1.00 0.00 O ATOM 2999 CB CYS B 92 6.954 -18.657 -2.685 1.00 0.00 C ATOM 3000 SG CYS B 92 7.127 -16.948 -3.167 1.00 0.00 S ATOM 0 H CYS B 92 8.910 -18.043 -1.197 1.00 0.00 H new ATOM 0 HA CYS B 92 8.017 -20.467 -2.331 1.00 0.00 H new ATOM 0 HB2 CYS B 92 6.281 -19.150 -3.386 1.00 0.00 H new ATOM 0 HB3 CYS B 92 6.478 -18.696 -1.705 1.00 0.00 H new ATOM 3005 N GLN B 93 10.061 -18.868 -4.167 1.00 0.00 N ATOM 3006 CA GLN B 93 10.789 -18.866 -5.412 1.00 0.00 C ATOM 3007 C GLN B 93 11.901 -19.910 -5.446 1.00 0.00 C ATOM 3008 O GLN B 93 12.575 -20.025 -6.468 1.00 0.00 O ATOM 3009 CB GLN B 93 11.390 -17.489 -5.706 1.00 0.00 C ATOM 3010 CG GLN B 93 10.375 -16.347 -5.734 1.00 0.00 C ATOM 3011 CD GLN B 93 9.329 -16.558 -6.823 1.00 0.00 C ATOM 3012 OE1 GLN B 93 9.663 -16.573 -8.008 1.00 0.00 O ATOM 3013 NE2 GLN B 93 8.094 -16.794 -6.418 1.00 0.00 N ATOM 0 H GLN B 93 10.522 -18.341 -3.425 1.00 0.00 H new ATOM 0 HA GLN B 93 10.059 -19.119 -6.181 1.00 0.00 H new ATOM 0 HB2 GLN B 93 12.146 -17.268 -4.952 1.00 0.00 H new ATOM 0 HB3 GLN B 93 11.901 -17.528 -6.668 1.00 0.00 H new ATOM 0 HG2 GLN B 93 9.883 -16.272 -4.764 1.00 0.00 H new ATOM 0 HG3 GLN B 93 10.892 -15.403 -5.903 1.00 0.00 H new ATOM 0 HE21 GLN B 93 7.870 -16.769 -5.423 1.00 0.00 H new ATOM 0 HE22 GLN B 93 7.364 -17.001 -7.100 1.00 0.00 H new ATOM 3022 N ILE B 94 12.184 -20.550 -4.315 1.00 0.00 N ATOM 3023 CA ILE B 94 13.328 -21.473 -4.259 1.00 0.00 C ATOM 3024 C ILE B 94 12.827 -22.914 -4.237 1.00 0.00 C ATOM 3025 O ILE B 94 12.072 -23.270 -3.346 1.00 0.00 O ATOM 3026 CB ILE B 94 14.184 -21.231 -3.005 1.00 0.00 C ATOM 3027 CG1 ILE B 94 14.687 -19.820 -2.893 1.00 0.00 C ATOM 3028 CG2 ILE B 94 15.340 -22.249 -2.956 1.00 0.00 C ATOM 3029 CD1 ILE B 94 15.286 -19.156 -4.071 1.00 0.00 C ATOM 0 H ILE B 94 11.659 -20.456 -3.446 1.00 0.00 H new ATOM 0 HA ILE B 94 13.941 -21.295 -5.143 1.00 0.00 H new ATOM 0 HB ILE B 94 13.539 -21.379 -2.139 1.00 0.00 H new ATOM 0 HG12 ILE B 94 13.852 -19.203 -2.562 1.00 0.00 H new ATOM 0 HG13 ILE B 94 15.431 -19.803 -2.097 1.00 0.00 H new ATOM 0 HG21 ILE B 94 15.943 -22.072 -2.065 1.00 0.00 H new ATOM 0 HG22 ILE B 94 14.934 -23.260 -2.924 1.00 0.00 H new ATOM 0 HG23 ILE B 94 15.962 -22.136 -3.844 1.00 0.00 H new ATOM 0 HD11 ILE B 94 15.591 -18.145 -3.803 1.00 0.00 H new ATOM 0 HD12 ILE B 94 16.156 -19.721 -4.404 1.00 0.00 H new ATOM 0 HD13 ILE B 94 14.552 -19.112 -4.876 1.00 0.00 H new ATOM 3041 N SER B 95 13.231 -23.695 -5.236 1.00 0.00 N ATOM 3042 CA SER B 95 12.804 -25.088 -5.319 1.00 0.00 C ATOM 3043 C SER B 95 13.936 -26.042 -4.934 1.00 0.00 C ATOM 3044 O SER B 95 15.109 -25.751 -5.156 1.00 0.00 O ATOM 3045 CB SER B 95 12.367 -25.412 -6.745 1.00 0.00 C ATOM 3046 OG SER B 95 11.928 -26.770 -6.813 1.00 0.00 O ATOM 0 H SER B 95 13.846 -23.391 -5.991 1.00 0.00 H new ATOM 0 HA SER B 95 11.975 -25.220 -4.624 1.00 0.00 H new ATOM 0 HB2 SER B 95 11.563 -24.743 -7.051 1.00 0.00 H new ATOM 0 HB3 SER B 95 13.195 -25.251 -7.436 1.00 0.00 H new ATOM 0 HG SER B 95 11.060 -26.811 -7.266 1.00 0.00 H new ATOM 3052 N LEU B 96 13.562 -27.153 -4.324 1.00 0.00 N ATOM 3053 CA LEU B 96 14.488 -28.101 -3.762 1.00 0.00 C ATOM 3054 C LEU B 96 15.400 -28.743 -4.783 1.00 0.00 C ATOM 3055 O LEU B 96 14.992 -29.106 -5.893 1.00 0.00 O ATOM 3056 CB LEU B 96 13.739 -29.170 -2.949 1.00 0.00 C ATOM 3057 CG LEU B 96 12.992 -28.659 -1.721 1.00 0.00 C ATOM 3058 CD1 LEU B 96 12.410 -29.783 -0.897 1.00 0.00 C ATOM 3059 CD2 LEU B 96 13.906 -27.791 -0.845 1.00 0.00 C ATOM 0 H LEU B 96 12.585 -27.420 -4.207 1.00 0.00 H new ATOM 0 HA LEU B 96 15.139 -27.531 -3.099 1.00 0.00 H new ATOM 0 HB2 LEU B 96 13.025 -29.667 -3.606 1.00 0.00 H new ATOM 0 HB3 LEU B 96 14.456 -29.926 -2.628 1.00 0.00 H new ATOM 0 HG LEU B 96 12.165 -28.052 -2.089 1.00 0.00 H new ATOM 0 HD11 LEU B 96 11.888 -29.369 -0.034 1.00 0.00 H new ATOM 0 HD12 LEU B 96 11.709 -30.355 -1.505 1.00 0.00 H new ATOM 0 HD13 LEU B 96 13.212 -30.437 -0.556 1.00 0.00 H new ATOM 0 HD21 LEU B 96 13.350 -27.439 0.024 1.00 0.00 H new ATOM 0 HD22 LEU B 96 14.761 -28.381 -0.514 1.00 0.00 H new ATOM 0 HD23 LEU B 96 14.257 -26.936 -1.422 1.00 0.00 H new ATOM 3071 N THR B 97 16.684 -28.833 -4.441 1.00 0.00 N ATOM 3072 CA THR B 97 17.664 -29.506 -5.300 1.00 0.00 C ATOM 3073 C THR B 97 18.400 -30.555 -4.463 1.00 0.00 C ATOM 3074 O THR B 97 18.342 -30.521 -3.229 1.00 0.00 O ATOM 3075 CB THR B 97 18.666 -28.556 -5.935 1.00 0.00 C ATOM 3076 OG1 THR B 97 19.504 -27.965 -4.923 1.00 0.00 O ATOM 3077 CG2 THR B 97 18.036 -27.471 -6.770 1.00 0.00 C ATOM 0 H THR B 97 17.072 -28.451 -3.579 1.00 0.00 H new ATOM 0 HA THR B 97 17.119 -29.966 -6.125 1.00 0.00 H new ATOM 0 HB THR B 97 19.262 -29.163 -6.616 1.00 0.00 H new ATOM 0 HG1 THR B 97 20.146 -27.356 -5.344 1.00 0.00 H new ATOM 0 HG21 THR B 97 18.816 -26.835 -7.188 1.00 0.00 H new ATOM 0 HG22 THR B 97 17.462 -27.922 -7.580 1.00 0.00 H new ATOM 0 HG23 THR B 97 17.374 -26.870 -6.147 1.00 0.00 H new ATOM 3085 N LYS B 98 19.142 -31.439 -5.125 1.00 0.00 N ATOM 3086 CA LYS B 98 19.920 -32.460 -4.449 1.00 0.00 C ATOM 3087 C LYS B 98 20.819 -31.869 -3.371 1.00 0.00 C ATOM 3088 O LYS B 98 20.912 -32.396 -2.260 1.00 0.00 O ATOM 3089 CB LYS B 98 20.805 -33.222 -5.456 1.00 0.00 C ATOM 3090 CG LYS B 98 20.244 -34.554 -5.912 1.00 0.00 C ATOM 3091 CD LYS B 98 21.260 -35.306 -6.775 1.00 0.00 C ATOM 3092 CE LYS B 98 20.575 -36.353 -7.637 1.00 0.00 C ATOM 3093 NZ LYS B 98 20.652 -37.712 -7.025 1.00 0.00 N ATOM 0 H LYS B 98 19.217 -31.464 -6.142 1.00 0.00 H new ATOM 0 HA LYS B 98 19.207 -33.139 -3.982 1.00 0.00 H new ATOM 0 HB2 LYS B 98 20.962 -32.591 -6.331 1.00 0.00 H new ATOM 0 HB3 LYS B 98 21.783 -33.390 -5.005 1.00 0.00 H new ATOM 0 HG2 LYS B 98 19.979 -35.158 -5.044 1.00 0.00 H new ATOM 0 HG3 LYS B 98 19.327 -34.392 -6.479 1.00 0.00 H new ATOM 0 HD2 LYS B 98 21.795 -34.600 -7.410 1.00 0.00 H new ATOM 0 HD3 LYS B 98 22.001 -35.785 -6.136 1.00 0.00 H new ATOM 0 HE2 LYS B 98 19.530 -36.078 -7.781 1.00 0.00 H new ATOM 0 HE3 LYS B 98 21.039 -36.372 -8.623 1.00 0.00 H new ATOM 0 HZ1 LYS B 98 20.174 -38.398 -7.643 1.00 0.00 H new ATOM 0 HZ2 LYS B 98 21.649 -37.985 -6.911 1.00 0.00 H new ATOM 0 HZ3 LYS B 98 20.187 -37.701 -6.095 1.00 0.00 H new ATOM 3107 N ALA B 99 21.512 -30.779 -3.705 1.00 0.00 N ATOM 3108 CA ALA B 99 22.463 -30.162 -2.812 1.00 0.00 C ATOM 3109 C ALA B 99 21.862 -29.654 -1.522 1.00 0.00 C ATOM 3110 O ALA B 99 22.594 -29.453 -0.545 1.00 0.00 O ATOM 3111 CB ALA B 99 23.257 -29.065 -3.515 1.00 0.00 C ATOM 0 H ALA B 99 21.421 -30.308 -4.605 1.00 0.00 H new ATOM 0 HA ALA B 99 23.146 -30.961 -2.524 1.00 0.00 H new ATOM 0 HB1 ALA B 99 23.964 -28.621 -2.814 1.00 0.00 H new ATOM 0 HB2 ALA B 99 23.801 -29.492 -4.357 1.00 0.00 H new ATOM 0 HB3 ALA B 99 22.574 -28.296 -3.877 1.00 0.00 H new ATOM 3117 N MET B 100 20.540 -29.522 -1.442 1.00 0.00 N ATOM 3118 CA MET B 100 19.861 -29.051 -0.263 1.00 0.00 C ATOM 3119 C MET B 100 19.480 -30.115 0.732 1.00 0.00 C ATOM 3120 O MET B 100 18.880 -29.822 1.777 1.00 0.00 O ATOM 3121 CB MET B 100 18.571 -28.284 -0.660 1.00 0.00 C ATOM 3122 CG MET B 100 18.873 -27.194 -1.676 1.00 0.00 C ATOM 3123 SD MET B 100 17.356 -26.276 -2.077 1.00 0.00 S ATOM 3124 CE MET B 100 18.032 -25.051 -3.195 1.00 0.00 C ATOM 0 H MET B 100 19.911 -29.746 -2.213 1.00 0.00 H new ATOM 0 HA MET B 100 20.590 -28.408 0.230 1.00 0.00 H new ATOM 0 HB2 MET B 100 17.843 -28.981 -1.075 1.00 0.00 H new ATOM 0 HB3 MET B 100 18.119 -27.842 0.228 1.00 0.00 H new ATOM 0 HG2 MET B 100 19.625 -26.513 -1.278 1.00 0.00 H new ATOM 0 HG3 MET B 100 19.290 -27.635 -2.581 1.00 0.00 H new ATOM 0 HE1 MET B 100 17.501 -24.108 -3.066 1.00 0.00 H new ATOM 0 HE2 MET B 100 19.090 -24.905 -2.978 1.00 0.00 H new ATOM 0 HE3 MET B 100 17.917 -25.394 -4.223 1.00 0.00 H new ATOM 3134 N ASP B 101 19.783 -31.386 0.422 1.00 0.00 N ATOM 3135 CA ASP B 101 19.477 -32.431 1.408 1.00 0.00 C ATOM 3136 C ASP B 101 20.136 -32.063 2.734 1.00 0.00 C ATOM 3137 O ASP B 101 21.345 -31.795 2.779 1.00 0.00 O ATOM 3138 CB ASP B 101 19.935 -33.796 0.931 1.00 0.00 C ATOM 3139 CG ASP B 101 19.108 -34.927 1.510 1.00 0.00 C ATOM 3140 OD1 ASP B 101 18.204 -34.656 2.330 1.00 0.00 O ATOM 3141 OD2 ASP B 101 19.347 -36.090 1.128 1.00 0.00 O ATOM 0 H ASP B 101 20.213 -31.702 -0.448 1.00 0.00 H new ATOM 0 HA ASP B 101 18.397 -32.491 1.542 1.00 0.00 H new ATOM 0 HB2 ASP B 101 19.882 -33.833 -0.157 1.00 0.00 H new ATOM 0 HB3 ASP B 101 20.981 -33.940 1.204 1.00 0.00 H new ATOM 3146 N ASN B 102 19.390 -32.115 3.815 1.00 0.00 N ATOM 3147 CA ASN B 102 19.827 -31.847 5.145 1.00 0.00 C ATOM 3148 C ASN B 102 20.161 -30.392 5.432 1.00 0.00 C ATOM 3149 O ASN B 102 20.699 -30.103 6.522 1.00 0.00 O ATOM 3150 CB ASN B 102 21.053 -32.716 5.536 1.00 0.00 C ATOM 3151 CG ASN B 102 20.800 -34.194 5.246 1.00 0.00 C ATOM 3152 OD1 ASN B 102 19.808 -34.757 5.680 1.00 0.00 O ATOM 3153 ND2 ASN B 102 21.695 -34.767 4.446 1.00 0.00 N ATOM 0 H ASN B 102 18.401 -32.362 3.773 1.00 0.00 H new ATOM 0 HA ASN B 102 18.960 -32.105 5.753 1.00 0.00 H new ATOM 0 HB2 ASN B 102 21.931 -32.380 4.984 1.00 0.00 H new ATOM 0 HB3 ASN B 102 21.273 -32.583 6.595 1.00 0.00 H new ATOM 0 HD21 ASN B 102 21.574 -35.738 4.158 1.00 0.00 H new ATOM 0 HD22 ASN B 102 22.502 -34.235 4.120 1.00 0.00 H new ATOM 3160 N MET B 103 19.882 -29.479 4.519 1.00 0.00 N ATOM 3161 CA MET B 103 20.186 -28.065 4.778 1.00 0.00 C ATOM 3162 C MET B 103 19.332 -27.523 5.921 1.00 0.00 C ATOM 3163 O MET B 103 18.274 -28.034 6.242 1.00 0.00 O ATOM 3164 CB MET B 103 19.994 -27.222 3.536 1.00 0.00 C ATOM 3165 CG MET B 103 18.537 -26.798 3.273 1.00 0.00 C ATOM 3166 SD MET B 103 18.471 -25.689 1.851 1.00 0.00 S ATOM 3167 CE MET B 103 16.692 -25.621 1.564 1.00 0.00 C ATOM 0 H MET B 103 19.457 -29.673 3.612 1.00 0.00 H new ATOM 0 HA MET B 103 21.235 -28.006 5.069 1.00 0.00 H new ATOM 0 HB2 MET B 103 20.610 -26.327 3.621 1.00 0.00 H new ATOM 0 HB3 MET B 103 20.359 -27.780 2.673 1.00 0.00 H new ATOM 0 HG2 MET B 103 17.920 -27.678 3.089 1.00 0.00 H new ATOM 0 HG3 MET B 103 18.129 -26.301 4.153 1.00 0.00 H new ATOM 0 HE1 MET B 103 16.487 -24.986 0.702 1.00 0.00 H new ATOM 0 HE2 MET B 103 16.316 -26.626 1.373 1.00 0.00 H new ATOM 0 HE3 MET B 103 16.197 -25.210 2.444 1.00 0.00 H new ATOM 3177 N THR B 104 19.761 -26.366 6.447 1.00 0.00 N ATOM 3178 CA THR B 104 18.955 -25.662 7.449 1.00 0.00 C ATOM 3179 C THR B 104 18.654 -24.250 6.945 1.00 0.00 C ATOM 3180 O THR B 104 19.540 -23.566 6.481 1.00 0.00 O ATOM 3181 CB THR B 104 19.708 -25.581 8.790 1.00 0.00 C ATOM 3182 OG1 THR B 104 19.895 -26.920 9.285 1.00 0.00 O ATOM 3183 CG2 THR B 104 18.949 -24.758 9.806 1.00 0.00 C ATOM 0 H THR B 104 20.639 -25.909 6.202 1.00 0.00 H new ATOM 0 HA THR B 104 18.026 -26.209 7.606 1.00 0.00 H new ATOM 0 HB THR B 104 20.669 -25.092 8.628 1.00 0.00 H new ATOM 0 HG1 THR B 104 20.375 -26.889 10.139 1.00 0.00 H new ATOM 0 HG21 THR B 104 19.511 -24.723 10.739 1.00 0.00 H new ATOM 0 HG22 THR B 104 18.814 -23.745 9.426 1.00 0.00 H new ATOM 0 HG23 THR B 104 17.974 -25.211 9.986 1.00 0.00 H new ATOM 3191 N VAL B 105 17.391 -23.825 7.078 1.00 0.00 N ATOM 3192 CA VAL B 105 17.004 -22.468 6.776 1.00 0.00 C ATOM 3193 C VAL B 105 16.477 -21.808 8.065 1.00 0.00 C ATOM 3194 O VAL B 105 15.992 -22.517 8.934 1.00 0.00 O ATOM 3195 CB VAL B 105 15.951 -22.314 5.685 1.00 0.00 C ATOM 3196 CG1 VAL B 105 16.469 -22.762 4.324 1.00 0.00 C ATOM 3197 CG2 VAL B 105 14.646 -23.033 6.020 1.00 0.00 C ATOM 0 H VAL B 105 16.624 -24.418 7.396 1.00 0.00 H new ATOM 0 HA VAL B 105 17.901 -21.986 6.389 1.00 0.00 H new ATOM 0 HB VAL B 105 15.734 -21.247 5.633 1.00 0.00 H new ATOM 0 HG11 VAL B 105 15.686 -22.635 3.577 1.00 0.00 H new ATOM 0 HG12 VAL B 105 17.335 -22.160 4.048 1.00 0.00 H new ATOM 0 HG13 VAL B 105 16.758 -23.812 4.372 1.00 0.00 H new ATOM 0 HG21 VAL B 105 13.933 -22.889 5.208 1.00 0.00 H new ATOM 0 HG22 VAL B 105 14.840 -24.098 6.149 1.00 0.00 H new ATOM 0 HG23 VAL B 105 14.233 -22.626 6.943 1.00 0.00 H new ATOM 3207 N ARG B 106 16.593 -20.483 8.140 1.00 0.00 N ATOM 3208 CA ARG B 106 16.129 -19.763 9.311 1.00 0.00 C ATOM 3209 C ARG B 106 14.993 -18.815 8.970 1.00 0.00 C ATOM 3210 O ARG B 106 15.051 -18.069 7.986 1.00 0.00 O ATOM 3211 CB ARG B 106 17.281 -18.969 9.973 1.00 0.00 C ATOM 3212 CG ARG B 106 16.782 -18.166 11.202 1.00 0.00 C ATOM 3213 CD ARG B 106 17.915 -17.403 11.827 1.00 0.00 C ATOM 3214 NE ARG B 106 18.980 -18.235 12.355 1.00 0.00 N ATOM 3215 CZ ARG B 106 18.934 -18.871 13.526 1.00 0.00 C ATOM 3216 NH1 ARG B 106 17.858 -18.809 14.296 1.00 0.00 N ATOM 3217 NH2 ARG B 106 19.979 -19.587 13.937 1.00 0.00 N ATOM 0 H ARG B 106 17.000 -19.898 7.410 1.00 0.00 H new ATOM 0 HA ARG B 106 15.761 -20.510 10.015 1.00 0.00 H new ATOM 0 HB2 ARG B 106 18.069 -19.657 10.281 1.00 0.00 H new ATOM 0 HB3 ARG B 106 17.720 -18.287 9.245 1.00 0.00 H new ATOM 0 HG2 ARG B 106 15.995 -17.476 10.898 1.00 0.00 H new ATOM 0 HG3 ARG B 106 16.345 -18.845 11.934 1.00 0.00 H new ATOM 0 HD2 ARG B 106 18.335 -16.726 11.083 1.00 0.00 H new ATOM 0 HD3 ARG B 106 17.520 -16.785 12.633 1.00 0.00 H new ATOM 0 HE ARG B 106 19.823 -18.341 11.791 1.00 0.00 H new ATOM 0 HH11 ARG B 106 17.047 -18.268 13.996 1.00 0.00 H new ATOM 0 HH12 ARG B 106 17.841 -19.302 15.189 1.00 0.00 H new ATOM 0 HH21 ARG B 106 20.815 -19.649 13.356 1.00 0.00 H new ATOM 0 HH22 ARG B 106 19.943 -20.073 14.833 1.00 0.00 H new ATOM 3231 N VAL B 107 13.946 -18.858 9.794 1.00 0.00 N ATOM 3232 CA VAL B 107 12.836 -17.941 9.693 1.00 0.00 C ATOM 3233 C VAL B 107 13.125 -16.748 10.631 1.00 0.00 C ATOM 3234 O VAL B 107 13.292 -16.856 11.793 1.00 0.00 O ATOM 3235 CB VAL B 107 11.495 -18.552 10.077 1.00 0.00 C ATOM 3236 CG1 VAL B 107 10.366 -17.544 9.874 1.00 0.00 C ATOM 3237 CG2 VAL B 107 11.204 -19.845 9.327 1.00 0.00 C ATOM 0 H VAL B 107 13.854 -19.537 10.550 1.00 0.00 H new ATOM 0 HA VAL B 107 12.751 -17.644 8.648 1.00 0.00 H new ATOM 0 HB VAL B 107 11.555 -18.808 11.135 1.00 0.00 H new ATOM 0 HG11 VAL B 107 9.416 -18.000 10.154 1.00 0.00 H new ATOM 0 HG12 VAL B 107 10.545 -16.667 10.496 1.00 0.00 H new ATOM 0 HG13 VAL B 107 10.330 -17.244 8.827 1.00 0.00 H new ATOM 0 HG21 VAL B 107 10.236 -20.237 9.639 1.00 0.00 H new ATOM 0 HG22 VAL B 107 11.187 -19.648 8.255 1.00 0.00 H new ATOM 0 HG23 VAL B 107 11.981 -20.577 9.549 1.00 0.00 H new ATOM 3247 N PRO B 108 13.280 -15.574 9.932 1.00 0.00 N ATOM 3248 CA PRO B 108 13.599 -14.372 10.697 1.00 0.00 C ATOM 3249 C PRO B 108 12.424 -13.802 11.444 1.00 0.00 C ATOM 3250 O PRO B 108 11.244 -14.073 11.103 1.00 0.00 O ATOM 3251 CB PRO B 108 14.134 -13.428 9.619 1.00 0.00 C ATOM 3252 CG PRO B 108 13.268 -13.739 8.449 1.00 0.00 C ATOM 3253 CD PRO B 108 13.102 -15.241 8.461 1.00 0.00 C ATOM 3254 OXT PRO B 108 12.646 -13.122 12.482 1.00 0.00 O ATOM 0 HA PRO B 108 14.311 -14.561 11.500 1.00 0.00 H new ATOM 0 HB2 PRO B 108 14.050 -12.383 9.918 1.00 0.00 H new ATOM 0 HB3 PRO B 108 15.186 -13.614 9.404 1.00 0.00 H new ATOM 0 HG2 PRO B 108 12.304 -13.236 8.529 1.00 0.00 H new ATOM 0 HG3 PRO B 108 13.727 -13.402 7.520 1.00 0.00 H new ATOM 0 HD2 PRO B 108 12.123 -15.545 8.091 1.00 0.00 H new ATOM 0 HD3 PRO B 108 13.846 -15.738 7.839 1.00 0.00 H new TER 3262 PRO B 108 HETATM 3263 FE HEC A 104 0.000 0.000 0.000 1.00 0.00 FE HETATM 3264 CHA HEC A 104 2.094 2.528 -0.877 1.00 0.00 C HETATM 3265 CHB HEC A 104 -2.464 2.278 0.522 1.00 0.00 C HETATM 3266 CHC HEC A 104 -2.165 -2.532 0.349 1.00 0.00 C HETATM 3267 CHD HEC A 104 2.555 -2.114 0.085 1.00 0.00 C HETATM 3268 NA HEC A 104 -0.111 1.961 -0.150 1.00 0.00 N HETATM 3269 C1A HEC A 104 0.802 2.877 -0.508 1.00 0.00 C HETATM 3270 C2A HEC A 104 0.198 4.205 -0.773 1.00 0.00 C HETATM 3271 C3A HEC A 104 -1.062 4.103 -0.348 1.00 0.00 C HETATM 3272 C4A HEC A 104 -1.334 2.781 0.011 1.00 0.00 C HETATM 3273 CMA HEC A 104 -2.137 5.255 -0.382 1.00 0.00 C HETATM 3274 CAA HEC A 104 1.028 5.384 -1.191 1.00 0.00 C HETATM 3275 CBA HEC A 104 1.565 6.111 0.084 1.00 0.00 C HETATM 3276 CGA HEC A 104 2.237 7.463 -0.095 1.00 0.00 C HETATM 3277 O1A HEC A 104 2.655 7.954 0.961 1.00 0.00 O HETATM 3278 O2A HEC A 104 2.342 7.976 -1.229 1.00 0.00 O HETATM 3279 NB HEC A 104 -1.964 -0.121 0.378 1.00 0.00 N HETATM 3280 C1B HEC A 104 -2.761 0.946 0.775 1.00 0.00 C HETATM 3281 C2B HEC A 104 -4.075 0.370 1.046 1.00 0.00 C HETATM 3282 C3B HEC A 104 -4.044 -0.982 0.942 1.00 0.00 C HETATM 3283 C4B HEC A 104 -2.677 -1.241 0.573 1.00 0.00 C HETATM 3284 CMB HEC A 104 -5.268 1.261 1.552 1.00 0.00 C HETATM 3285 CAB HEC A 104 -5.087 -2.036 1.202 1.00 0.00 C HETATM 3286 CBB HEC A 104 -6.021 -2.306 0.011 1.00 0.00 C HETATM 3287 NC HEC A 104 0.210 -1.969 0.181 1.00 0.00 N HETATM 3288 C1C HEC A 104 -0.756 -2.921 0.310 1.00 0.00 C HETATM 3289 C2C HEC A 104 -0.339 -4.252 0.512 1.00 0.00 C HETATM 3290 C3C HEC A 104 1.000 -4.142 0.390 1.00 0.00 C HETATM 3291 C4C HEC A 104 1.352 -2.730 0.274 1.00 0.00 C HETATM 3292 CMC HEC A 104 -1.162 -5.490 0.698 1.00 0.00 C HETATM 3293 CAC HEC A 104 2.141 -5.167 0.685 1.00 0.00 C HETATM 3294 CBC HEC A 104 1.944 -6.486 -0.095 1.00 0.00 C HETATM 3295 ND HEC A 104 1.970 0.160 -0.324 1.00 0.00 N HETATM 3296 C1D HEC A 104 2.912 -0.858 -0.241 1.00 0.00 C HETATM 3297 C2D HEC A 104 4.172 -0.362 -0.549 1.00 0.00 C HETATM 3298 C3D HEC A 104 4.044 0.938 -0.855 1.00 0.00 C HETATM 3299 C4D HEC A 104 2.621 1.260 -0.786 1.00 0.00 C HETATM 3300 CMD HEC A 104 5.522 -1.211 -0.627 1.00 0.00 C HETATM 3301 CAD HEC A 104 5.177 1.850 -1.392 1.00 0.00 C HETATM 3302 CBD HEC A 104 5.091 2.071 -2.884 1.00 0.00 C HETATM 3303 CGD HEC A 104 6.317 2.606 -3.601 1.00 0.00 C HETATM 3304 O1D HEC A 104 7.153 3.245 -2.906 1.00 0.00 O HETATM 3305 O2D HEC A 104 6.279 2.497 -4.847 1.00 0.00 O HETATM 0 HMD3 HEC A 104 5.718 -1.672 0.341 1.00 0.00 H new HETATM 0 HMD2 HEC A 104 5.420 -1.987 -1.385 1.00 0.00 H new HETATM 0 HMD1 HEC A 104 6.351 -0.554 -0.890 1.00 0.00 H new HETATM 0 HMC3 HEC A 104 -1.793 -5.379 1.580 1.00 0.00 H new HETATM 0 HMC2 HEC A 104 -1.790 -5.645 -0.180 1.00 0.00 H new HETATM 0 HMC1 HEC A 104 -0.503 -6.349 0.829 1.00 0.00 H new HETATM 0 HMB3 HEC A 104 -4.998 1.726 2.500 1.00 0.00 H new HETATM 0 HMB2 HEC A 104 -5.481 2.036 0.816 1.00 0.00 H new HETATM 0 HMB1 HEC A 104 -6.153 0.640 1.691 1.00 0.00 H new HETATM 0 HMA3 HEC A 104 -1.786 6.098 0.213 1.00 0.00 H new HETATM 0 HMA2 HEC A 104 -2.292 5.578 -1.412 1.00 0.00 H new HETATM 0 HMA1 HEC A 104 -3.077 4.887 0.029 1.00 0.00 H new HETATM 0 HBD2 HEC A 104 4.823 1.121 -3.346 1.00 0.00 H new HETATM 0 HBD1 HEC A 104 4.268 2.761 -3.072 1.00 0.00 H new HETATM 0 HBC3 HEC A 104 0.995 -6.940 0.191 1.00 0.00 H new HETATM 0 HBC2 HEC A 104 1.939 -6.279 -1.165 1.00 0.00 H new HETATM 0 HBC1 HEC A 104 2.759 -7.172 0.138 1.00 0.00 H new HETATM 0 HBB3 HEC A 104 -6.551 -1.390 -0.251 1.00 0.00 H new HETATM 0 HBB2 HEC A 104 -5.433 -2.642 -0.843 1.00 0.00 H new HETATM 0 HBB1 HEC A 104 -6.742 -3.078 0.282 1.00 0.00 H new HETATM 0 HBA2 HEC A 104 0.729 6.242 0.771 1.00 0.00 H new HETATM 0 HBA1 HEC A 104 2.277 5.446 0.572 1.00 0.00 H new HETATM 0 HAD2 HEC A 104 5.134 2.813 -0.883 1.00 0.00 H new HETATM 0 HAD1 HEC A 104 6.142 1.404 -1.150 1.00 0.00 H new HETATM 0 HAA2 HEC A 104 1.860 5.056 -1.815 1.00 0.00 H new HETATM 0 HAA1 HEC A 104 0.431 6.070 -1.791 1.00 0.00 H new HETATM 0 HHD HEC A 104 3.406 -2.780 0.228 1.00 0.00 H new HETATM 0 HHC HEC A 104 -2.895 -3.325 0.188 1.00 0.00 H new HETATM 0 HHB HEC A 104 -3.243 2.999 0.769 1.00 0.00 H new HETATM 0 HHA HEC A 104 2.738 3.316 -1.267 1.00 0.00 H new HETATM 0 H2D HEC A 104 5.387 2.199 -5.122 1.00 0.00 H new HETATM 0 H2A HEC A 104 1.618 7.650 -1.804 1.00 0.00 H new HETATM 3338 FE1 FES B 109 4.370 -14.172 -0.885 1.00 0.00 FE HETATM 3339 FE2 FES B 109 6.469 -15.734 -1.312 1.00 0.00 FE HETATM 3340 S1 FES B 109 6.183 -13.700 -2.032 1.00 0.00 S HETATM 3341 S2 FES B 109 4.562 -16.331 -0.472 1.00 0.00 S